[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxidanylidene-ethyl] 2-phenylquinoline-4-carboxylate

Systemtic Name: [2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxidanylidene-ethyl] 2-phenylquinoline-4-carboxylate Openeye Name: [2-[(1-morpholinocyclohexyl)methylamino]-2-oxo-ethyl] 2-phenylquinoline-4-carboxylate CAS Name: 2-phenyl-4-quinolinecarboxylic acid [2-[[1-(4-morpholinyl)cyclohexyl]methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxoethyl] 2-phenylquinoline-4-carboxylate Traditional Name: 2-phenylcinchoninic acid [2-keto-2-[(1-morpholinocyclohexyl)methylamino]ethyl] ester Formula: C29H33N3O4 MolecularWeight: 487.59002

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)N5CCOCC5

Isomeric SMILES

C1CCC(CC1)(CNC(=O)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)N5CCOCC5

InChI

InChI=1S/C29H33N3O4/c33-27(30-21-29(13-7-2-8-14-29)32-15-17-35-18-16-32)20-36-28(34)24-19-26(22-9-3-1-4-10-22)31-25-12-6-5-11-23(24)25/h1,3-6,9-12,19H,2,7-8,13-18,20-21H2,(H,30,33)