methyl 3-[2-[(E)-3-oxidanylidene-3-phenylmethoxy-prop-1-enyl]pyrrol-1-yl]benzoate

Systemtic Name: methyl 3-[2-[(E)-3-oxidanylidene-3-phenylmethoxy-prop-1-enyl]pyrrol-1-yl]benzoate Openeye Name: methyl 3-[2-[(E)-3-benzyloxy-3-oxo-prop-1-enyl]pyrrol-1-yl]benzoate CAS Name: 3-[2-[(E)-3-oxo-3-phenylmethoxyprop-1-enyl]-1-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 3-[2-[(E)-3-oxo-3-phenylmethoxyprop-1-enyl]pyrrol-1-yl]benzoate Traditional Name: 3-[2-[(E)-3-benzoxy-3-keto-prop-1-enyl]pyrrol-1-yl]benzoic acid methyl ester Formula: C22H19NO4 MolecularWeight: 361.39056

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)N2C=CC=C2C=CC(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)N2C=CC=C2/C=C/C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H19NO4/c1-26-22(25)18-9-5-10-20(15-18)23-14-6-11-19(23)12-13-21(24)27-16-17-7-3-2-4-8-17/h2-15H,16H2,1H3/b13-12+