[3-[[3-oxidanylidene-4-(3-piperidin-1-ylpropyl)piperazin-1-yl]methyl]-2-phenyl-quinolin-4-yl] N-(1-cyclohexylethyl)carbamate

Systemtic Name: [3-[[3-oxidanylidene-4-(3-piperidin-1-ylpropyl)piperazin-1-yl]methyl]-2-phenyl-quinolin-4-yl] N-(1-cyclohexylethyl)carbamate Openeye Name: [3-[[3-oxo-4-[3-(1-piperidyl)propyl]piperazin-1-yl]methyl]-2-phenyl-4-quinolyl] N-(1-cyclohexylethyl)carbamate CAS Name: N-(1-cyclohexylethyl)carbamic acid [3-[[3-oxo-4-[3-(1-piperidinyl)propyl]-1-piperazinyl]methyl]-2-phenyl-4-quinolinyl] ester IUPAC Name: [3-[[3-oxo-4-(3-piperidin-1-ylpropyl)piperazin-1-yl]methyl]-2-phenylquinolin-4-yl] N-(1-cyclohexylethyl)carbamate Traditional Name: N-(1-cyclohexylethyl)carbamic acid [3-[[3-keto-4-(3-piperidinopropyl)piperazino]methyl]-2-phenyl-4-quinolyl] ester Formula: C37H49N5O3 MolecularWeight: 611.81666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCCC1)NC(=O)OC2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)CN5CCN(C(=O)C5)CCCN6CCCCC6

Isomeric SMILES

CC(C1CCCCC1)NC(=O)OC2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)CN5CCN(C(=O)C5)CCCN6CCCCC6

InChI

InChI=1S/C37H49N5O3/c1-28(29-14-5-2-6-15-29)38-37(44)45-36-31-18-9-10-19-33(31)39-35(30-16-7-3-8-17-30)32(36)26-41-24-25-42(34(43)27-41)23-13-22-40-20-11-4-12-21-40/h3,7-10,16-19,28-29H,2,4-6,11-15,20-27H2,1H3,(H,38,44)