methyl 4-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-3-oxidanylidene-1,2-dihydrocyclopenta[b]indole-6-carboxylate

Systemtic Name: methyl 4-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-3-oxidanylidene-1,2-dihydrocyclopenta[b]indole-6-carboxylate Openeye Name: methyl 4-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-oxo-1,2-dihydrocyclopenta[b]indole-6-carboxylate CAS Name: 4-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-oxo-1,2-dihydrocyclopenta[b]indole-6-carboxylic acid methyl ester IUPAC Name: methyl 4-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-oxo-1,2-dihydrocyclopenta[b]indole-6-carboxylate Traditional Name: 4-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-keto-1,2-dihydrocyclopent[b]indole-6-carboxylic acid methyl ester Formula: C21H16ClNO5 MolecularWeight: 397.80844

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C3=C(N2CC4=CC5=C(C=C4Cl)OCO5)C(=O)CC3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C3=C(N2CC4=CC5=C(C=C4Cl)OCO5)C(=O)CC3

InChI

InChI=1S/C21H16ClNO5/c1-26-21(25)11-2-3-13-14-4-5-17(24)20(14)23(16(13)6-11)9-12-7-18-19(8-15(12)22)28-10-27-18/h2-3,6-8H,4-5,9-10H2,1H3