Summary

Molecular formula: C17H21NO5
SMILES: CCOC(=O)CC/C(=C/Cc1c(O)cc2c(c1O)CNC2=O)/C
InChI: InChI=1S/C17H21NO5/c1-3-23-15(20)7-5-10(2)4-6-11-14(19)8-12-13(16(11)21)9-18-17(12)22/h4,8,19,21H,3,5-7,9H2,1-2H3,(H,18,22)/b10-4+
InChIKey: DJPYXBQXHRJAHM-ONNFQVAWSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1NCc2ccccc21

Scaffold Graph/Node level:
OC1NCC2CCCCC21

Scaffold Graph level:
CC1CCC2CCCCC12

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Chemical classification

Kingdom: Organic compounds
Super class: Organoheterocyclic compounds
Class: Isoindoles and derivatives
Sub class: Isoindoles

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Synonymous chemical names:
erinacerin r

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External chemical identifiers:
CID_132599516; NPATLAS_NPA010960; CHEMSPIDER_78434881

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Chemical structure download