methyl 5-chloranyl-2-[(E)-4-[2-(4-methoxyphenyl)carbonyl-4-methyl-pyrrol-1-yl]but-1-enyl]benzoate

Systemtic Name: methyl 5-chloranyl-2-[(E)-4-[2-(4-methoxyphenyl)carbonyl-4-methyl-pyrrol-1-yl]but-1-enyl]benzoate Openeye Name: methyl 5-chloro-2-[(E)-4-[2-(4-methoxybenzoyl)-4-methyl-pyrrol-1-yl]but-1-enyl]benzoate CAS Name: 5-chloro-2-[(E)-4-[2-[(4-methoxyphenyl)-oxomethyl]-4-methyl-1-pyrrolyl]but-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 5-chloro-2-[(E)-4-[2-(4-methoxybenzoyl)-4-methylpyrrol-1-yl]but-1-enyl]benzoate Traditional Name: 5-chloro-2-[(E)-4-(4-methyl-2-p-anisoyl-pyrrol-1-yl)but-1-enyl]benzoic acid methyl ester Formula: C25H24ClNO4 MolecularWeight: 437.91536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=C1)C(=O)C2=CC=C(C=C2)OC)CCC=CC3=C(C=C(C=C3)Cl)C(=O)OC

Isomeric SMILES

CC1=CN(C(=C1)C(=O)C2=CC=C(C=C2)OC)CC/C=C/C3=C(C=C(C=C3)Cl)C(=O)OC

InChI

InChI=1S/C25H24ClNO4/c1-17-14-23(24(28)19-8-11-21(30-2)12-9-19)27(16-17)13-5-4-6-18-7-10-20(26)15-22(18)25(29)31-3/h4,6-12,14-16H,5,13H2,1-3H3/b6-4+