methyl 5-chloranyl-2-[(1E,3E)-5-[2-(4-methoxyphenyl)carbonyl-4-methyl-pyrrol-1-yl]penta-1,3-dienyl]benzoate

Systemtic Name: methyl 5-chloranyl-2-[(1E,3E)-5-[2-(4-methoxyphenyl)carbonyl-4-methyl-pyrrol-1-yl]penta-1,3-dienyl]benzoate Openeye Name: methyl 5-chloro-2-[(1E,3E)-5-[2-(4-methoxybenzoyl)-4-methyl-pyrrol-1-yl]penta-1,3-dienyl]benzoate CAS Name: 5-chloro-2-[(1E,3E)-5-[2-[(4-methoxyphenyl)-oxomethyl]-4-methyl-1-pyrrolyl]penta-1,3-dienyl]benzoic acid methyl ester IUPAC Name: methyl 5-chloro-2-[(1E,3E)-5-[2-(4-methoxybenzoyl)-4-methylpyrrol-1-yl]penta-1,3-dienyl]benzoate Traditional Name: 5-chloro-2-[(1E,3E)-5-(4-methyl-2-p-anisoyl-pyrrol-1-yl)penta-1,3-dienyl]benzoic acid methyl ester Formula: C26H24ClNO4 MolecularWeight: 449.92606

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H24ClNO4/c1-18-15-24(25(29)20-9-12-22(31-2)13-10-20)28(17-18)14-6-4-5-7-19-8-11-21(27)16-23(19)26(30)32-3/h4-13,15-17H,14H2,1-3H3/b6-4+,7-5+