6-[[4-[(3-chlorophenyl)methylamino]cyclohexyl]amino]-2H-isoquinolin-1-one

Systemtic Name: 6-[[4-[(3-chlorophenyl)methylamino]cyclohexyl]amino]-2H-isoquinolin-1-one Openeye Name: 6-[[4-[(3-chlorophenyl)methylamino]cyclohexyl]amino]-2H-isoquinolin-1-one CAS Name: 6-[[4-[(3-chlorophenyl)methylamino]cyclohexyl]amino]-2H-isoquinolin-1-one IUPAC Name: 6-[[4-[(3-chlorophenyl)methylamino]cyclohexyl]amino]-2H-isoquinolin-1-one Traditional Name: 6-[[4-[(3-chlorobenzyl)amino]cyclohexyl]amino]isocarbostyril Formula: C22H24ClN3O MolecularWeight: 381.89846

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NCC2=CC(=CC=C2)Cl)NC3=CC4=C(C=C3)C(=O)NC=C4

Isomeric SMILES

C1CC(CCC1NCC2=CC(=CC=C2)Cl)NC3=CC4=C(C=C3)C(=O)NC=C4

InChI

InChI=1S/C22H24ClN3O/c23-17-3-1-2-15(12-17)14-25-18-4-6-19(7-5-18)26-20-8-9-21-16(13-20)10-11-24-22(21)27/h1-3,8-13,18-19,25-26H,4-7,14H2,(H,24,27)