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

Systemtic Name: 2-ethoxy-4-[2-oxidanylidene-2-[[[4-(phenylmethyl)phenyl]-piperidin-1-yl-methyl]amino]ethyl]benzoic acid Openeye Name: 4-[2-[[(4-benzylphenyl)-(1-piperidyl)methyl]amino]-2-oxo-ethyl]-2-ethoxy-benzoic acid CAS Name: 2-ethoxy-4-[2-oxo-2-[[[4-(phenylmethyl)phenyl]-(1-piperidinyl)methyl]amino]ethyl]benzoic acid IUPAC Name: 4-[2-[[(4-benzylphenyl)-piperidin-1-ylmethyl]amino]-2-oxoethyl]-2-ethoxybenzoic acid Traditional Name: 4-[2-[[(4-benzylphenyl)-piperidino-methyl]amino]-2-keto-ethyl]-2-ethoxy-benzoic acid Formula: C30H34N2O4 MolecularWeight: 486.60196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CC(=O)NC(C2=CC=C(C=C2)CC3=CC=CC=C3)N4CCCCC4)C(=O)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)CC(=O)NC(C2=CC=C(C=C2)CC3=CC=CC=C3)N4CCCCC4)C(=O)O

InChI

InChI=1S/C30H34N2O4/c1-2-36-27-20-24(13-16-26(27)30(34)35)21-28(33)31-29(32-17-7-4-8-18-32)25-14-11-23(12-15-25)19-22-9-5-3-6-10-22/h3,5-6,9-16,20,29H,2,4,7-8,17-19,21H2,1H3,(H,31,33)(H,34,35)