methyl 3-[4-(3,5-dimethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)butyl]indole-1-carboxylate

Systemtic Name: methyl 3-[4-(3,5-dimethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)butyl]indole-1-carboxylate Openeye Name: methyl 3-[4-(3,5-dimethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)butyl]indole-1-carboxylate CAS Name: 3-[4-(3,5-dimethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)butyl]-1-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-[4-(3,5-dimethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)butyl]indole-1-carboxylate Traditional Name: 3-[4-(4-keto-3,5-dimethoxy-cyclohexa-2,5-dien-1-ylidene)butyl]indole-1-carboxylic acid methyl ester Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CCCCC2=CN(C3=CC=CC=C32)C(=O)OC)C=C(C1=O)OC

Isomeric SMILES

COC1=CC(=CCCCC2=CN(C3=CC=CC=C32)C(=O)OC)C=C(C1=O)OC

InChI

InChI=1S/C22H23NO5/c1-26-19-12-15(13-20(27-2)21(19)24)8-4-5-9-16-14-23(22(25)28-3)18-11-7-6-10-17(16)18/h6-8,10-14H,4-5,9H2,1-3H3