1-(2,3-dihydro-1,4-benzoxazin-4-yl)-2-[3,4-dihydro-2H-quinolin-1-yl-[1-[3-(trifluoromethyl)phenyl]propan-2-yl]amino]-2-(1-ethylpiperidin-4-yl)ethanone hydrochloride

Systemtic Name: 1-(2,3-dihydro-1,4-benzoxazin-4-yl)-2-[3,4-dihydro-2H-quinolin-1-yl-[1-[3-(trifluoromethyl)phenyl]propan-2-yl]amino]-2-(1-ethylpiperidin-4-yl)ethanone hydrochloride Openeye Name: 1-(2,3-dihydro-1,4-benzoxazin-4-yl)-2-[3,4-dihydro-2H-quinolin-1-yl-[1-methyl-2-[3-(trifluoromethyl)phenyl]ethyl]amino]-2-(1-ethyl-4-piperidyl)ethanone hydrochloride CAS Name: 1-(2,3-dihydro-1,4-benzoxazin-4-yl)-2-[3,4-dihydro-2H-quinolin-1-yl-[1-[3-(trifluoromethyl)phenyl]propan-2-yl]amino]-2-(1-ethyl-4-piperidinyl)ethanone hydrochloride IUPAC Name: 1-(2,3-dihydro-1,4-benzoxazin-4-yl)-2-[3,4-dihydro-2H-quinolin-1-yl-[1-[3-(trifluoromethyl)phenyl]propan-2-yl]amino]-2-(1-ethylpiperidin-4-yl)ethanone hydrochloride Traditional Name: 1-(2,3-dihydro-1,4-benzoxazin-4-yl)-2-[3,4-dihydro-2H-quinolin-1-yl-[1-methyl-2-[3-(trifluoromethyl)phenyl]ethyl]amino]-2-(1-ethyl-4-piperidyl)ethanone hydrochloride Formula: C36H44ClF3N4O2 MolecularWeight: 657.20837

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CC1)C(C(=O)N2CCOC3=CC=CC=C32)N(C(C)CC4=CC(=CC=C4)C(F)(F)F)N5CCCC6=CC=CC=C65.Cl

Isomeric SMILES

CCN1CCC(CC1)C(C(=O)N2CCOC3=CC=CC=C32)N(C(C)CC4=CC(=CC=C4)C(F)(F)F)N5CCCC6=CC=CC=C65.Cl

InChI

InChI=1S/C36H43F3N4O2.ClH/c1-3-40-20-17-29(18-21-40)34(35(44)41-22-23-45-33-16-7-6-15-32(33)41)43(42-19-9-12-28-11-4-5-14-31(28)42)26(2)24-27-10-8-13-30(25-27)36(37,38)39;/h4-8,10-11,13-16,25-26,29,34H,3,9,12,17-24H2,1-2H3;1H