methyl (5Z)-2-ethoxy-1-methyl-4-oxidanylidene-5-(phenylmethylidene)pyrrole-3-carboxylate

Systemtic Name: methyl (5Z)-2-ethoxy-1-methyl-4-oxidanylidene-5-(phenylmethylidene)pyrrole-3-carboxylate Openeye Name: methyl (5Z)-5-benzylidene-2-ethoxy-1-methyl-4-oxo-pyrrole-3-carboxylate CAS Name: (5Z)-2-ethoxy-1-methyl-4-oxo-5-(phenylmethylene)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (5Z)-5-benzylidene-2-ethoxy-1-methyl-4-oxopyrrole-3-carboxylate Traditional Name: (5Z)-5-benzal-2-ethoxy-4-keto-1-methyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=O)C(=CC2=CC=CC=C2)N1C)C(=O)OC

Isomeric SMILES

CCOC1=C(C(=O)/C(=C/C2=CC=CC=C2)/N1C)C(=O)OC

InChI

InChI=1S/C16H17NO4/c1-4-21-15-13(16(19)20-3)14(18)12(17(15)2)10-11-8-6-5-7-9-11/h5-10H,4H2,1-3H3/b12-10-