ethyl 2-(4-methoxyphenyl)-1,3-dimethyl-6-oxidanylidene-cyclohepta[c]pyrrole-5-carboxylate

Systemtic Name: ethyl 2-(4-methoxyphenyl)-1,3-dimethyl-6-oxidanylidene-cyclohepta[c]pyrrole-5-carboxylate Openeye Name: ethyl 2-(4-methoxyphenyl)-1,3-dimethyl-6-oxo-cyclohepta[c]pyrrole-5-carboxylate CAS Name: 2-(4-methoxyphenyl)-1,3-dimethyl-6-oxo-5-cyclohepta[c]pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-methoxyphenyl)-1,3-dimethyl-6-oxocyclohepta[c]pyrrole-5-carboxylate Traditional Name: 6-keto-2-(4-methoxyphenyl)-1,3-dimethyl-cyclohepta[c]pyrrole-5-carboxylic acid ethyl ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N(C(=C2C=CC1=O)C)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(N(C(=C2C=CC1=O)C)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C21H21NO4/c1-5-26-21(24)19-12-18-14(3)22(13(2)17(18)10-11-20(19)23)15-6-8-16(25-4)9-7-15/h6-12H,5H2,1-4H3