2-[5-(3,4-dimethylphenyl)carbonyl-1-(phenylmethyl)pyrrol-2-yl]propanoic acid

Systemtic Name: 2-[5-(3,4-dimethylphenyl)carbonyl-1-(phenylmethyl)pyrrol-2-yl]propanoic acid Openeye Name: 2-[1-benzyl-5-(3,4-dimethylbenzoyl)pyrrol-2-yl]propanoic acid CAS Name: 2-[5-[(3,4-dimethylphenyl)-oxomethyl]-1-(phenylmethyl)-2-pyrrolyl]propanoic acid IUPAC Name: 2-[1-benzyl-5-(3,4-dimethylbenzoyl)pyrrol-2-yl]propanoic acid Traditional Name: 2-[1-benzyl-5-(3,4-dimethylbenzoyl)pyrrol-2-yl]propionic acid Formula: C23H23NO3 MolecularWeight: 361.43362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C2=CC=C(N2CC3=CC=CC=C3)C(C)C(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C2=CC=C(N2CC3=CC=CC=C3)C(C)C(=O)O)C

InChI

InChI=1S/C23H23NO3/c1-15-9-10-19(13-16(15)2)22(25)21-12-11-20(17(3)23(26)27)24(21)14-18-7-5-4-6-8-18/h4-13,17H,14H2,1-3H3,(H,26,27)