5-chloranyl-2-[(E)-3-[2-(4-methoxyphenyl)carbonyl-4-methyl-pyrrol-1-yl]prop-1-enyl]benzoic acid

Systemtic Name: 5-chloranyl-2-[(E)-3-[2-(4-methoxyphenyl)carbonyl-4-methyl-pyrrol-1-yl]prop-1-enyl]benzoic acid Openeye Name: 5-chloro-2-[(E)-3-[2-(4-methoxybenzoyl)-4-methyl-pyrrol-1-yl]prop-1-enyl]benzoic acid CAS Name: 5-chloro-2-[(E)-3-[2-[(4-methoxyphenyl)-oxomethyl]-4-methyl-1-pyrrolyl]prop-1-enyl]benzoic acid IUPAC Name: 5-chloro-2-[(E)-3-[2-(4-methoxybenzoyl)-4-methylpyrrol-1-yl]prop-1-enyl]benzoic acid Traditional Name: 5-chloro-2-[(E)-3-(4-methyl-2-p-anisoyl-pyrrol-1-yl)prop-1-enyl]benzoic acid Formula: C23H20ClNO4 MolecularWeight: 409.8622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20ClNO4/c1-15-12-21(22(26)17-6-9-19(29-2)10-7-17)25(14-15)11-3-4-16-5-8-18(24)13-20(16)23(27)28/h3-10,12-14H,11H2,1-2H3,(H,27,28)/b4-3+