5-azanyl-6-cyclohexyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-methylpropyl)-4-oxidanyl-hexan-1-one hydrochloride

Systemtic Name: 5-azanyl-6-cyclohexyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-methylpropyl)-4-oxidanyl-hexan-1-one hydrochloride Openeye Name: 5-amino-6-cyclohexyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-hydroxy-2-isobutyl-hexan-1-one hydrochloride CAS Name: 5-amino-6-cyclohexyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-hydroxy-2-(2-methylpropyl)-1-hexanone hydrochloride IUPAC Name: 5-amino-6-cyclohexyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-hydroxy-2-(2-methylpropyl)hexan-1-one hydrochloride Traditional Name: 5-amino-6-cyclohexyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-hydroxy-2-isobutyl-hexan-1-one hydrochloride Formula: C25H41ClN2O2 MolecularWeight: 437.05824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(C(CC1CCCCC1)N)O)C(=O)N2CCC3=CC=CC=C3C2.Cl

Isomeric SMILES

CC(C)CC(CC(C(CC1CCCCC1)N)O)C(=O)N2CCC3=CC=CC=C3C2.Cl

InChI

InChI=1S/C25H40N2O2.ClH/c1-18(2)14-22(16-24(28)23(26)15-19-8-4-3-5-9-19)25(29)27-13-12-20-10-6-7-11-21(20)17-27;/h6-7,10-11,18-19,22-24,28H,3-5,8-9,12-17,26H2,1-2H3;1H