ethyl 4-[[4-[[1-(1-methyl-4-oxidanylidene-quinolin-3-yl)carbonylpiperidin-3-yl]methoxy]phenyl]methyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[4-[[1-(1-methyl-4-oxidanylidene-quinolin-3-yl)carbonylpiperidin-3-yl]methoxy]phenyl]methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[4-[[1-(1-methyl-4-oxo-quinoline-3-carbonyl)-3-piperidyl]methoxy]phenyl]methyl]piperazine-1-carboxylate CAS Name: 4-[[4-[[1-[(1-methyl-4-oxo-3-quinolinyl)-oxomethyl]-3-piperidinyl]methoxy]phenyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-[[1-(1-methyl-4-oxoquinoline-3-carbonyl)piperidin-3-yl]methoxy]phenyl]methyl]piperazine-1-carboxylate Traditional Name: 4-[4-[[1-(4-keto-1-methyl-quinoline-3-carbonyl)-3-piperidyl]methoxy]benzyl]piperazine-1-carboxylic acid ethyl ester Formula: C31H38N4O5 MolecularWeight: 546.65722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC2=CC=C(C=C2)OCC3CCCN(C3)C(=O)C4=CN(C5=CC=CC=C5C4=O)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC2=CC=C(C=C2)OCC3CCCN(C3)C(=O)C4=CN(C5=CC=CC=C5C4=O)C

InChI

InChI=1S/C31H38N4O5/c1-3-39-31(38)34-17-15-33(16-18-34)19-23-10-12-25(13-11-23)40-22-24-7-6-14-35(20-24)30(37)27-21-32(2)28-9-5-4-8-26(28)29(27)36/h4-5,8-13,21,24H,3,6-7,14-20,22H2,1-2H3