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

Systemtic Name: 4-[3-[4-[(2-fluorophenyl)carbamoylamino]-3-methoxy-phenyl]-1-methoxy-2-oxidanylidene-1-pyrrolidin-1-yl-propoxy]benzoic acid Openeye Name: 4-[3-[4-[(2-fluorophenyl)carbamoylamino]-3-methoxy-phenyl]-1-methoxy-2-oxo-1-pyrrolidin-1-yl-propoxy]benzoic acid CAS Name: 4-[3-[4-[[(2-fluoroanilino)-oxomethyl]amino]-3-methoxyphenyl]-1-methoxy-2-oxo-1-(1-pyrrolidinyl)propoxy]benzoic acid IUPAC Name: 4-[3-[4-[(2-fluorophenyl)carbamoylamino]-3-methoxyphenyl]-1-methoxy-2-oxo-1-pyrrolidin-1-ylpropoxy]benzoic acid Traditional Name: 4-[3-[4-[(2-fluorophenyl)carbamoylamino]-3-methoxy-phenyl]-2-keto-1-methoxy-1-pyrrolidino-propoxy]benzoic acid Formula: C29H30FN3O7 MolecularWeight: 551.562803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC(=O)C(N2CCCC2)(OC)OC3=CC=C(C=C3)C(=O)O)NC(=O)NC4=CC=CC=C4F

Isomeric SMILES

COC1=C(C=CC(=C1)CC(=O)C(N2CCCC2)(OC)OC3=CC=C(C=C3)C(=O)O)NC(=O)NC4=CC=CC=C4F

InChI

InChI=1S/C29H30FN3O7/c1-38-25-17-19(9-14-24(25)32-28(37)31-23-8-4-3-7-22(23)30)18-26(34)29(39-2,33-15-5-6-16-33)40-21-12-10-20(11-13-21)27(35)36/h3-4,7-14,17H,5-6,15-16,18H2,1-2H3,(H,35,36)(H2,31,32,37)