4-[1-fluoranyl-3-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]-2-oxidanylidene-1-pyrrolidin-1-yl-propoxy]benzoic acid

Systemtic Name: 4-[1-fluoranyl-3-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]-2-oxidanylidene-1-pyrrolidin-1-yl-propoxy]benzoic acid Openeye Name: 4-[1-fluoro-3-[3-methoxy-4-(o-tolylcarbamoylamino)phenyl]-2-oxo-1-pyrrolidin-1-yl-propoxy]benzoic acid CAS Name: 4-[1-fluoro-3-[3-methoxy-4-[[(2-methylanilino)-oxomethyl]amino]phenyl]-2-oxo-1-(1-pyrrolidinyl)propoxy]benzoic acid IUPAC Name: 4-[1-fluoro-3-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]-2-oxo-1-pyrrolidin-1-ylpropoxy]benzoic acid Traditional Name: 4-[1-fluoro-2-keto-3-[3-methoxy-4-(o-tolylcarbamoylamino)phenyl]-1-pyrrolidino-propoxy]benzoic acid Formula: C29H30FN3O6 MolecularWeight: 535.563403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NC2=C(C=C(C=C2)CC(=O)C(N3CCCC3)(OC4=CC=C(C=C4)C(=O)O)F)OC

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NC2=C(C=C(C=C2)CC(=O)C(N3CCCC3)(OC4=CC=C(C=C4)C(=O)O)F)OC

InChI

InChI=1S/C29H30FN3O6/c1-19-7-3-4-8-23(19)31-28(37)32-24-14-9-20(17-25(24)38-2)18-26(34)29(30,33-15-5-6-16-33)39-22-12-10-21(11-13-22)27(35)36/h3-4,7-14,17H,5-6,15-16,18H2,1-2H3,(H,35,36)(H2,31,32,37)