methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-oxidanylidene-4-(thiophen-2-ylmethylidene)pyrrole-3-carboxylate

Systemtic Name: methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-oxidanylidene-4-(thiophen-2-ylmethylidene)pyrrole-3-carboxylate Openeye Name: methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-oxo-4-(2-thienylmethylene)pyrrole-3-carboxylate CAS Name: (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-oxo-4-(thiophen-2-ylmethylidene)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-oxo-4-(thiophen-2-ylmethylidene)pyrrole-3-carboxylate Traditional Name: (4Z)-1-homoveratryl-5-keto-2-methyl-4-(2-thenylidene)-2-pyrroline-3-carboxylic acid methyl ester Formula: C22H23NO5S MolecularWeight: 413.48672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=CC=CS2)C(=O)N1CCC3=CC(=C(C=C3)OC)OC)C(=O)OC

Isomeric SMILES

CC1=C(/C(=C/C2=CC=CS2)/C(=O)N1CCC3=CC(=C(C=C3)OC)OC)C(=O)OC

InChI

InChI=1S/C22H23NO5S/c1-14-20(22(25)28-4)17(13-16-6-5-11-29-16)21(24)23(14)10-9-15-7-8-18(26-2)19(12-15)27-3/h5-8,11-13H,9-10H2,1-4H3/b17-13-