2-ethoxy-4-[2-[[4-methyl-2-(2-piperidin-1-ylphenyl)pentan-2-yl]amino]-2-oxidanylidene-ethyl]benzoic acid

Systemtic Name: 2-ethoxy-4-[2-[[4-methyl-2-(2-piperidin-1-ylphenyl)pentan-2-yl]amino]-2-oxidanylidene-ethyl]benzoic acid Openeye Name: 4-[2-[[1,3-dimethyl-1-[2-(1-piperidyl)phenyl]butyl]amino]-2-oxo-ethyl]-2-ethoxy-benzoic acid CAS Name: 2-ethoxy-4-[2-[[4-methyl-2-[2-(1-piperidinyl)phenyl]pentan-2-yl]amino]-2-oxoethyl]benzoic acid IUPAC Name: 2-ethoxy-4-[2-[[4-methyl-2-(2-piperidin-1-ylphenyl)pentan-2-yl]amino]-2-oxoethyl]benzoic acid Traditional Name: 4-[2-[[1,3-dimethyl-1-(2-piperidinophenyl)butyl]amino]-2-keto-ethyl]-2-ethoxy-benzoic acid Formula: C28H38N2O4 MolecularWeight: 466.61232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CC(=O)NC(C)(CC(C)C)C2=CC=CC=C2N3CCCCC3)C(=O)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)CC(=O)NC(C)(CC(C)C)C2=CC=CC=C2N3CCCCC3)C(=O)O

InChI

InChI=1S/C28H38N2O4/c1-5-34-25-17-21(13-14-22(25)27(32)33)18-26(31)29-28(4,19-20(2)3)23-11-7-8-12-24(23)30-15-9-6-10-16-30/h7-8,11-14,17,20H,5-6,9-10,15-16,18-19H2,1-4H3,(H,29,31)(H,32,33)