Summary

IMPPAT Phytochemical identifier: IMPHY016212

Phytochemical name: 1H-Cyclopropa[a]naphthalene

Synonymous chemical names:
1h-cyclopropa[a]naphthalene

External chemical identifiers:
CID:12343165, SureChEMBL:SCHEMBL2535555

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Chemical structure information

SMILES:
c1ccc2c(c1)ccc1c2C1

InChI:
InChI=1S/C11H8/c1-2-4-10-8(3-1)5-6-9-7-11(9)10/h1-6H,7H2

InChIKey:
ZITVKGIRQCDOSX-UHFFFAOYSA-N

DeepSMILES:
cccccc6)cccc6C3

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1ccc2c3c(ccc2c1)C3

Scaffold Graph/Node level:
C1CCC2C(C1)CCC1CC12

Scaffold Graph level:
C1CCC2C(C1)CCC1CC12

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Benzenoids

ClassyFire Class: Naphthalenes

NP-Likeness score: 0.207

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Chemical structure download