[2-(1-methyl-4-phenyl-piperidin-4-yl)oxy-2-oxidanylidene-ethyl] 2-[(7-chloranylquinolin-4-yl)amino]benzoate

Systemtic Name: [2-(1-methyl-4-phenyl-piperidin-4-yl)oxy-2-oxidanylidene-ethyl] 2-[(7-chloranylquinolin-4-yl)amino]benzoate Openeye Name: [2-[(1-methyl-4-phenyl-4-piperidyl)oxy]-2-oxo-ethyl] 2-[(7-chloro-4-quinolyl)amino]benzoate CAS Name: 2-[(7-chloro-4-quinolinyl)amino]benzoic acid [2-[(1-methyl-4-phenyl-4-piperidinyl)oxy]-2-oxoethyl] ester IUPAC Name: [2-(1-methyl-4-phenylpiperidin-4-yl)oxy-2-oxoethyl] 2-[(7-chloroquinolin-4-yl)amino]benzoate Traditional Name: 2-[(7-chloro-4-quinolyl)amino]benzoic acid [2-keto-2-[(1-methyl-4-phenyl-4-piperidyl)oxy]ethyl] ester Formula: C30H28ClN3O4 MolecularWeight: 530.01402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)(C2=CC=CC=C2)OC(=O)COC(=O)C3=CC=CC=C3NC4=C5C=CC(=CC5=NC=C4)Cl

Isomeric SMILES

CN1CCC(CC1)(C2=CC=CC=C2)OC(=O)COC(=O)C3=CC=CC=C3NC4=C5C=CC(=CC5=NC=C4)Cl

InChI

InChI=1S/C30H28ClN3O4/c1-34-17-14-30(15-18-34,21-7-3-2-4-8-21)38-28(35)20-37-29(36)24-9-5-6-10-25(24)33-26-13-16-32-27-19-22(31)11-12-23(26)27/h2-13,16,19H,14-15,17-18,20H2,1H3,(H,32,33)