6-[4-(1-azanyl-2-methyl-propyl)-4-cyclopropyl-1-methyl-cyclohexyl]oxy-7-chloranyl-2H-isoquinolin-1-one

Systemtic Name: 6-[4-(1-azanyl-2-methyl-propyl)-4-cyclopropyl-1-methyl-cyclohexyl]oxy-7-chloranyl-2H-isoquinolin-1-one Openeye Name: 6-[4-(1-amino-2-methyl-propyl)-4-cyclopropyl-1-methyl-cyclohexoxy]-7-chloro-2H-isoquinolin-1-one CAS Name: 6-[4-(1-amino-2-methylpropyl)-4-cyclopropyl-1-methylcyclohexyl]oxy-7-chloro-2H-isoquinolin-1-one IUPAC Name: 6-[4-(1-amino-2-methylpropyl)-4-cyclopropyl-1-methylcyclohexyl]oxy-7-chloro-2H-isoquinolin-1-one Traditional Name: 6-[4-(1-amino-2-methyl-propyl)-4-cyclopropyl-1-methyl-cyclohexoxy]-7-chloro-isocarbostyril Formula: C23H31ClN2O2 MolecularWeight: 402.95744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1(CCC(CC1)(C)OC2=C(C=C3C(=C2)C=CNC3=O)Cl)C4CC4)N

Isomeric SMILES

CC(C)C(C1(CCC(CC1)(C)OC2=C(C=C3C(=C2)C=CNC3=O)Cl)C4CC4)N

InChI

InChI=1S/C23H31ClN2O2/c1-14(2)20(25)23(16-4-5-16)9-7-22(3,8-10-23)28-19-12-15-6-11-26-21(27)17(15)13-18(19)24/h6,11-14,16,20H,4-5,7-10,25H2,1-3H3,(H,26,27)