7-[[[1-(2-imidazol-1-ylethanoyl)-2-phenyl-piperidin-3-yl]amino]methyl]-6-methoxy-1-methyl-3,4-dihydroquinolin-2-one dihydrochloride

Systemtic Name: 7-[[[1-(2-imidazol-1-ylethanoyl)-2-phenyl-piperidin-3-yl]amino]methyl]-6-methoxy-1-methyl-3,4-dihydroquinolin-2-one dihydrochloride Openeye Name: 7-[[[1-(2-imidazol-1-ylacetyl)-2-phenyl-3-piperidyl]amino]methyl]-6-methoxy-1-methyl-3,4-dihydroquinolin-2-one dihydrochloride CAS Name: 7-[[[1-[2-(1-imidazolyl)-1-oxoethyl]-2-phenyl-3-piperidinyl]amino]methyl]-6-methoxy-1-methyl-3,4-dihydroquinolin-2-one dihydrochloride IUPAC Name: 7-[[[1-(2-imidazol-1-ylacetyl)-2-phenylpiperidin-3-yl]amino]methyl]-6-methoxy-1-methyl-3,4-dihydroquinolin-2-one dihydrochloride Traditional Name: 7-[[[1-(2-imidazol-1-ylacetyl)-2-phenyl-3-piperidyl]amino]methyl]-6-methoxy-1-methyl-3,4-dihydrocarbostyril dihydrochloride Formula: C28H35Cl2N5O3 MolecularWeight: 560.5152

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CCC2=CC(=C(C=C21)CNC3CCCN(C3C4=CC=CC=C4)C(=O)CN5C=CN=C5)OC.Cl.Cl

Isomeric SMILES

CN1C(=O)CCC2=CC(=C(C=C21)CNC3CCCN(C3C4=CC=CC=C4)C(=O)CN5C=CN=C5)OC.Cl.Cl

InChI

InChI=1S/C28H33N5O3.2ClH/c1-31-24-15-22(25(36-2)16-21(24)10-11-26(31)34)17-30-23-9-6-13-33(27(35)18-32-14-12-29-19-32)28(23)20-7-4-3-5-8-20;;/h3-5,7-8,12,14-16,19,23,28,30H,6,9-11,13,17-18H2,1-2H3;2*1H