ethyl 4-methyl-2-[[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-1-yl]methyl]quinoline-3-carboxylate

Systemtic Name: ethyl 4-methyl-2-[[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-1-yl]methyl]quinoline-3-carboxylate Openeye Name: ethyl 4-methyl-2-[[4-[2-oxo-2-(1-piperidyl)ethyl]piperazin-1-yl]methyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[[4-[2-oxo-2-(1-piperidinyl)ethyl]-1-piperazinyl]methyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]methyl]quinoline-3-carboxylate Traditional Name: 2-[[4-(2-keto-2-piperidino-ethyl)piperazino]methyl]-4-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C25H34N4O3 MolecularWeight: 438.56246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1CN3CCN(CC3)CC(=O)N4CCCCC4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1CN3CCN(CC3)CC(=O)N4CCCCC4)C

InChI

InChI=1S/C25H34N4O3/c1-3-32-25(31)24-19(2)20-9-5-6-10-21(20)26-22(24)17-27-13-15-28(16-14-27)18-23(30)29-11-7-4-8-12-29/h5-6,9-10H,3-4,7-8,11-18H2,1-2H3