Summary

Molecular formula: C12H18N2O
SMILES: CC1=C2NC(CC2=NC(C1=O)(C)C)(C)C
InChI: InChI=1S/C12H18N2O/c1-7-9-8(6-11(2,3)14-9)13-12(4,5)10(7)15/h14H,6H2,1-5H3
InChIKey: OTBGQBSPIWKINO-UHFFFAOYSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1C=C2NCCC2=NC1

Scaffold Graph/Node level:
OC1CNC2CCNC2C1

Scaffold Graph level:
CC1CCC2CCCC2C1

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Chemical classification

Kingdom: Organic compounds
Super class: Organoheterocyclic compounds
Class: Pyrrolopyridines

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Synonymous chemical names:
agrocybenine

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External chemical identifiers:
CID_23278458; CAS_178764-92-6; NPATLAS_NPA005150; CHEMSPIDER_10446240; ZINC_ZINC000085566876; Molport_MolPort-039-338-266

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Chemical structure download