2-(diphenylmethyl)oxy-5-[(2-ethylpyridin-4-yl)methylcarbamoylamino]benzoic acid

Systemtic Name: 2-(diphenylmethyl)oxy-5-[(2-ethylpyridin-4-yl)methylcarbamoylamino]benzoic acid Openeye Name: 2-benzhydryloxy-5-[(2-ethyl-4-pyridyl)methylcarbamoylamino]benzoic acid CAS Name: 2-(diphenylmethyl)oxy-5-[[[(2-ethyl-4-pyridinyl)methylamino]-oxomethyl]amino]benzoic acid IUPAC Name: 2-benzhydryloxy-5-[(2-ethylpyridin-4-yl)methylcarbamoylamino]benzoic acid Traditional Name: 2-benzhydryloxy-5-[(2-ethyl-4-pyridyl)methylcarbamoylamino]benzoic acid Formula: C29H27N3O4 MolecularWeight: 481.54238

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=CC(=C1)CNC(=O)NC2=CC(=C(C=C2)OC(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CCC1=NC=CC(=C1)CNC(=O)NC2=CC(=C(C=C2)OC(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C29H27N3O4/c1-2-23-17-20(15-16-30-23)19-31-29(35)32-24-13-14-26(25(18-24)28(33)34)36-27(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-18,27H,2,19H2,1H3,(H,33,34)(H2,31,32,35)