methyl (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-methyl-5-oxidanylidene-1-[(1R)-1-phenylethyl]pyrrole-3-carboxylate

Systemtic Name: methyl (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-methyl-5-oxidanylidene-1-[(1R)-1-phenylethyl]pyrrole-3-carboxylate Openeye Name: methyl (4Z)-4-(1,3-benzodioxol-5-ylmethylene)-2-methyl-5-oxo-1-[(1R)-1-phenylethyl]pyrrole-3-carboxylate CAS Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-methyl-5-oxo-1-[(1R)-1-phenylethyl]-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-methyl-5-oxo-1-[(1R)-1-phenylethyl]pyrrole-3-carboxylate Traditional Name: (4Z)-5-keto-2-methyl-1-[(1R)-1-phenylethyl]-4-piperonylidene-2-pyrroline-3-carboxylic acid methyl ester Formula: C23H21NO5 MolecularWeight: 391.41654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=CC3=C(C=C2)OCO3)C(=O)N1C(C)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C(/C(=C/C2=CC3=C(C=C2)OCO3)/C(=O)N1[C@H](C)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C23H21NO5/c1-14(17-7-5-4-6-8-17)24-15(2)21(23(26)27-3)18(22(24)25)11-16-9-10-19-20(12-16)29-13-28-19/h4-12,14H,13H2,1-3H3/b18-11-/t14-/m1/s1