7-chloranyl-6-[4-cyclopropyl-4-(propan-2-ylamino)cyclohexyl]oxy-2H-isoquinolin-1-one

Systemtic Name: 7-chloranyl-6-[4-cyclopropyl-4-(propan-2-ylamino)cyclohexyl]oxy-2H-isoquinolin-1-one Openeye Name: 7-chloro-6-[4-cyclopropyl-4-(isopropylamino)cyclohexoxy]-2H-isoquinolin-1-one CAS Name: 7-chloro-6-[4-cyclopropyl-4-(propan-2-ylamino)cyclohexyl]oxy-2H-isoquinolin-1-one IUPAC Name: 7-chloro-6-[4-cyclopropyl-4-(propan-2-ylamino)cyclohexyl]oxy-2H-isoquinolin-1-one Traditional Name: 7-chloro-6-[4-cyclopropyl-4-(isopropylamino)cyclohexoxy]isocarbostyril Formula: C21H27ClN2O2 MolecularWeight: 374.90428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1(CCC(CC1)OC2=C(C=C3C(=C2)C=CNC3=O)Cl)C4CC4

Isomeric SMILES

CC(C)NC1(CCC(CC1)OC2=C(C=C3C(=C2)C=CNC3=O)Cl)C4CC4

InChI

InChI=1S/C21H27ClN2O2/c1-13(2)24-21(15-3-4-15)8-5-16(6-9-21)26-19-11-14-7-10-23-20(25)17(14)12-18(19)22/h7,10-13,15-16,24H,3-6,8-9H2,1-2H3,(H,23,25)