6-[4-(1-azanylpropyl)-4-ethyl-cyclohexyl]oxy-5,7-dimethyl-2H-isoquinolin-1-one

Systemtic Name: 6-[4-(1-azanylpropyl)-4-ethyl-cyclohexyl]oxy-5,7-dimethyl-2H-isoquinolin-1-one Openeye Name: 6-[4-(1-aminopropyl)-4-ethyl-cyclohexoxy]-5,7-dimethyl-2H-isoquinolin-1-one CAS Name: 6-[4-(1-aminopropyl)-4-ethylcyclohexyl]oxy-5,7-dimethyl-2H-isoquinolin-1-one IUPAC Name: 6-[4-(1-aminopropyl)-4-ethylcyclohexyl]oxy-5,7-dimethyl-2H-isoquinolin-1-one Traditional Name: 6-[4-(1-aminopropyl)-4-ethyl-cyclohexoxy]-5,7-dimethyl-isocarbostyril Formula: C22H32N2O2 MolecularWeight: 356.50168

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1(CCC(CC1)OC2=C(C=C3C(=C2C)C=CNC3=O)C)CC)N

Isomeric SMILES

CCC(C1(CCC(CC1)OC2=C(C=C3C(=C2C)C=CNC3=O)C)CC)N

InChI

InChI=1S/C22H32N2O2/c1-5-19(23)22(6-2)10-7-16(8-11-22)26-20-14(3)13-18-17(15(20)4)9-12-24-21(18)25/h9,12-13,16,19H,5-8,10-11,23H2,1-4H3,(H,24,25)