methyl (5Z)-4-methoxy-2-[(phenylmethyl)amino]-5-(phenylmethylidene)pyrrole-3-carboxylate

Systemtic Name: methyl (5Z)-4-methoxy-2-[(phenylmethyl)amino]-5-(phenylmethylidene)pyrrole-3-carboxylate Openeye Name: methyl (5Z)-2-(benzylamino)-5-benzylidene-4-methoxy-pyrrole-3-carboxylate CAS Name: (5Z)-4-methoxy-2-[(phenylmethyl)amino]-5-(phenylmethylene)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (5Z)-2-(benzylamino)-5-benzylidene-4-methoxypyrrole-3-carboxylate Traditional Name: (5Z)-5-benzal-2-(benzylamino)-4-methoxy-pyrrole-3-carboxylic acid methyl ester Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=NC1=CC2=CC=CC=C2)NCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC\1=C(C(=N/C1=C\C2=CC=CC=C2)NCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C21H20N2O3/c1-25-19-17(13-15-9-5-3-6-10-15)23-20(18(19)21(24)26-2)22-14-16-11-7-4-8-12-16/h3-13H,14H2,1-2H3,(H,22,23)/b17-13-