2-methoxy-5-[[(1-naphthalen-1-ylcarbonylpiperidin-3-yl)carbonylamino]methyl]benzoic acid

Systemtic Name: 2-methoxy-5-[[(1-naphthalen-1-ylcarbonylpiperidin-3-yl)carbonylamino]methyl]benzoic acid Openeye Name: 2-methoxy-5-[[[1-(naphthalene-1-carbonyl)piperidine-3-carbonyl]amino]methyl]benzoic acid CAS Name: 2-methoxy-5-[[[[1-[1-naphthalenyl(oxo)methyl]-3-piperidinyl]-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 2-methoxy-5-[[[1-(naphthalene-1-carbonyl)piperidine-3-carbonyl]amino]methyl]benzoic acid Traditional Name: 2-methoxy-5-[[[1-(1-naphthoyl)nipecotoyl]amino]methyl]benzoic acid Formula: C26H26N2O5 MolecularWeight: 446.49504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2CCCN(C2)C(=O)C3=CC=CC4=CC=CC=C43)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2CCCN(C2)C(=O)C3=CC=CC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C26H26N2O5/c1-33-23-12-11-17(14-22(23)26(31)32)15-27-24(29)19-8-5-13-28(16-19)25(30)21-10-4-7-18-6-2-3-9-20(18)21/h2-4,6-7,9-12,14,19H,5,8,13,15-16H2,1H3,(H,27,29)(H,31,32)