methyl 4-[1-[3-methyl-5-oxidanylidene-1-(phenylmethyl)-2H-pyrrol-4-yl]ethenyl]benzoate

Systemtic Name: methyl 4-[1-[3-methyl-5-oxidanylidene-1-(phenylmethyl)-2H-pyrrol-4-yl]ethenyl]benzoate Openeye Name: methyl 4-[1-(1-benzyl-3-methyl-5-oxo-2H-pyrrol-4-yl)vinyl]benzoate CAS Name: 4-[1-[3-methyl-5-oxo-1-(phenylmethyl)-2H-pyrrol-4-yl]ethenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[1-(1-benzyl-3-methyl-5-oxo-2H-pyrrol-4-yl)ethenyl]benzoate Traditional Name: 4-[1-(1-benzyl-2-keto-4-methyl-3-pyrrolin-3-yl)vinyl]benzoic acid methyl ester Formula: C22H21NO3 MolecularWeight: 347.40704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C1)CC2=CC=CC=C2)C(=C)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(=O)N(C1)CC2=CC=CC=C2)C(=C)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H21NO3/c1-15-13-23(14-17-7-5-4-6-8-17)21(24)20(15)16(2)18-9-11-19(12-10-18)22(25)26-3/h4-12H,2,13-14H2,1,3H3