5-bromanyl-2-methoxy-4-[2-[[(2-methoxyphenyl)-(2-methyl-6-piperidin-1-yl-phenyl)methyl]amino]-2-oxidanylidene-ethyl]benzoic acid

Systemtic Name: 5-bromanyl-2-methoxy-4-[2-[[(2-methoxyphenyl)-(2-methyl-6-piperidin-1-yl-phenyl)methyl]amino]-2-oxidanylidene-ethyl]benzoic acid Openeye Name: 5-bromo-2-methoxy-4-[2-[[(2-methoxyphenyl)-[2-methyl-6-(1-piperidyl)phenyl]methyl]amino]-2-oxo-ethyl]benzoic acid CAS Name: 5-bromo-2-methoxy-4-[2-[[(2-methoxyphenyl)-[2-methyl-6-(1-piperidinyl)phenyl]methyl]amino]-2-oxoethyl]benzoic acid IUPAC Name: 5-bromo-2-methoxy-4-[2-[[(2-methoxyphenyl)-(2-methyl-6-piperidin-1-ylphenyl)methyl]amino]-2-oxoethyl]benzoic acid Traditional Name: 5-bromo-4-[2-keto-2-[[(2-methoxyphenyl)-(2-methyl-6-piperidino-phenyl)methyl]amino]ethyl]-2-methoxy-benzoic acid Formula: C30H33BrN2O5 MolecularWeight: 581.49742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCCCC2)C(C3=CC=CC=C3OC)NC(=O)CC4=C(C=C(C(=C4)OC)C(=O)O)Br

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCCCC2)C(C3=CC=CC=C3OC)NC(=O)CC4=C(C=C(C(=C4)OC)C(=O)O)Br

InChI

InChI=1S/C30H33BrN2O5/c1-19-10-9-12-24(33-14-7-4-8-15-33)28(19)29(21-11-5-6-13-25(21)37-2)32-27(34)17-20-16-26(38-3)22(30(35)36)18-23(20)31/h5-6,9-13,16,18,29H,4,7-8,14-15,17H2,1-3H3,(H,32,34)(H,35,36)