4-[2-methyl-5-[(2-pyrrolidin-1-ylpyridin-4-yl)carbonylamino]phenyl]benzoic acid

Systemtic Name: 4-[2-methyl-5-[(2-pyrrolidin-1-ylpyridin-4-yl)carbonylamino]phenyl]benzoic acid Openeye Name: 4-[2-methyl-5-[(2-pyrrolidin-1-ylpyridine-4-carbonyl)amino]phenyl]benzoic acid CAS Name: 4-[2-methyl-5-[[oxo-[2-(1-pyrrolidinyl)-4-pyridinyl]methyl]amino]phenyl]benzoic acid IUPAC Name: 4-[2-methyl-5-[(2-pyrrolidin-1-ylpyridine-4-carbonyl)amino]phenyl]benzoic acid Traditional Name: 4-[2-methyl-5-[(2-pyrrolidinoisonicotinoyl)amino]phenyl]benzoic acid Formula: C24H23N3O3 MolecularWeight: 401.45772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC=C2)N3CCCC3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC=C2)N3CCCC3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C24H23N3O3/c1-16-4-9-20(15-21(16)17-5-7-18(8-6-17)24(29)30)26-23(28)19-10-11-25-22(14-19)27-12-2-3-13-27/h4-11,14-15H,2-3,12-13H2,1H3,(H,26,28)(H,29,30)