[2-(1-butylpiperidin-3-yl)oxy-2-oxidanylidene-ethyl] 2-[(7-chloranylquinolin-4-yl)amino]benzoate

Systemtic Name: [2-(1-butylpiperidin-3-yl)oxy-2-oxidanylidene-ethyl] 2-[(7-chloranylquinolin-4-yl)amino]benzoate Openeye Name: [2-[(1-butyl-3-piperidyl)oxy]-2-oxo-ethyl] 2-[(7-chloro-4-quinolyl)amino]benzoate CAS Name: 2-[(7-chloro-4-quinolinyl)amino]benzoic acid [2-[(1-butyl-3-piperidinyl)oxy]-2-oxoethyl] ester IUPAC Name: [2-(1-butylpiperidin-3-yl)oxy-2-oxoethyl] 2-[(7-chloroquinolin-4-yl)amino]benzoate Traditional Name: 2-[(7-chloro-4-quinolyl)amino]benzoic acid [2-[(1-butyl-3-piperidyl)oxy]-2-keto-ethyl] ester Formula: C27H30ClN3O4 MolecularWeight: 495.9978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCCC(C1)OC(=O)COC(=O)C2=CC=CC=C2NC3=C4C=CC(=CC4=NC=C3)Cl

Isomeric SMILES

CCCCN1CCCC(C1)OC(=O)COC(=O)C2=CC=CC=C2NC3=C4C=CC(=CC4=NC=C3)Cl

InChI

InChI=1S/C27H30ClN3O4/c1-2-3-14-31-15-6-7-20(17-31)35-26(32)18-34-27(33)22-8-4-5-9-23(22)30-24-12-13-29-25-16-19(28)10-11-21(24)25/h4-5,8-13,16,20H,2-3,6-7,14-15,17-18H2,1H3,(H,29,30)