4-[2-(5-cyano-2-phenylmethoxy-phenyl)ethanoylamino]-2-methyl-benzoic acid

Systemtic Name: 4-[2-(5-cyano-2-phenylmethoxy-phenyl)ethanoylamino]-2-methyl-benzoic acid Openeye Name: 4-[[2-(2-benzyloxy-5-cyano-phenyl)acetyl]amino]-2-methyl-benzoic acid CAS Name: 4-[[2-(5-cyano-2-phenylmethoxyphenyl)-1-oxoethyl]amino]-2-methylbenzoic acid IUPAC Name: 4-[[2-(5-cyano-2-phenylmethoxyphenyl)acetyl]amino]-2-methylbenzoic acid Traditional Name: 4-[[2-(2-benzoxy-5-cyano-phenyl)acetyl]amino]-2-methyl-benzoic acid Formula: C24H20N2O4 MolecularWeight: 400.4266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CC2=C(C=CC(=C2)C#N)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CC2=C(C=CC(=C2)C#N)OCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C24H20N2O4/c1-16-11-20(8-9-21(16)24(28)29)26-23(27)13-19-12-18(14-25)7-10-22(19)30-15-17-5-3-2-4-6-17/h2-12H,13,15H2,1H3,(H,26,27)(H,28,29)