5-bromanyl-2-methoxy-4-[2-[2-(4-methoxyphenyl)-2-(2-piperidin-1-ylphenyl)hydrazinyl]-2-oxidanylidene-ethyl]benzoic acid

Systemtic Name: 5-bromanyl-2-methoxy-4-[2-[2-(4-methoxyphenyl)-2-(2-piperidin-1-ylphenyl)hydrazinyl]-2-oxidanylidene-ethyl]benzoic acid Openeye Name: 5-bromo-2-methoxy-4-[2-[2-(4-methoxyphenyl)-2-[2-(1-piperidyl)phenyl]hydrazino]-2-oxo-ethyl]benzoic acid CAS Name: 5-bromo-2-methoxy-4-[2-[2-(4-methoxyphenyl)-2-[2-(1-piperidinyl)phenyl]hydrazinyl]-2-oxoethyl]benzoic acid IUPAC Name: 5-bromo-2-methoxy-4-[2-[2-(4-methoxyphenyl)-2-(2-piperidin-1-ylphenyl)hydrazinyl]-2-oxoethyl]benzoic acid Traditional Name: 5-bromo-4-[2-keto-2-[N'-(4-methoxyphenyl)-N'-(2-piperidinophenyl)hydrazino]ethyl]-2-methoxy-benzoic acid Formula: C28H30BrN3O5 MolecularWeight: 568.4589

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(C2=CC=CC=C2N3CCCCC3)NC(=O)CC4=C(C=C(C(=C4)OC)C(=O)O)Br

Isomeric SMILES

COC1=CC=C(C=C1)N(C2=CC=CC=C2N3CCCCC3)NC(=O)CC4=C(C=C(C(=C4)OC)C(=O)O)Br

InChI

InChI=1S/C28H30BrN3O5/c1-36-21-12-10-20(11-13-21)32(25-9-5-4-8-24(25)31-14-6-3-7-15-31)30-27(33)17-19-16-26(37-2)22(28(34)35)18-23(19)29/h4-5,8-13,16,18H,3,6-7,14-15,17H2,1-2H3,(H,30,33)(H,34,35)