Summary

IMPPAT Phytochemical identifier: IMPHY016166

Phytochemical name: 1-Nonyl-1,2,3,4-tetrahydronaphthalene

Synonymous chemical names:
1,2,3,4-tetrahydro-1-nonylnaphthalene

External chemical identifiers:
CID:583060

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Chemical structure information

SMILES:
CCCCCCCCCC1CCCc2c1cccc2

InChI:
InChI=1S/C19H30/c1-2-3-4-5-6-7-8-12-17-14-11-15-18-13-9-10-16-19(17)18/h9-10,13,16-17H,2-8,11-12,14-15H2,1H3

InChIKey:
QMOFHSNOIHJCKA-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCcc6cccc6

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1ccc2c(c1)CCCC2

Scaffold Graph/Node level:
C1CCC2CCCCC2C1

Scaffold Graph level:
C1CCC2CCCCC2C1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Benzenoids

ClassyFire Class: Tetralins

NP-Likeness score: 0.282

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Chemical structure download