4-[(4-phenylpiperazin-1-yl)methyl]-3-propan-2-yl-2H-isoquinolin-1-one

Systemtic Name: 4-[(4-phenylpiperazin-1-yl)methyl]-3-propan-2-yl-2H-isoquinolin-1-one Openeye Name: 3-isopropyl-4-[(4-phenylpiperazin-1-yl)methyl]-2H-isoquinolin-1-one CAS Name: 4-[(4-phenyl-1-piperazinyl)methyl]-3-propan-2-yl-2H-isoquinolin-1-one IUPAC Name: 4-[(4-phenylpiperazin-1-yl)methyl]-3-propan-2-yl-2H-isoquinolin-1-one Traditional Name: 3-isopropyl-4-[(4-phenylpiperazino)methyl]isocarbostyril Formula: C23H27N3O MolecularWeight: 361.47998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C2=CC=CC=C2C(=O)N1)CN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)C1=C(C2=CC=CC=C2C(=O)N1)CN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H27N3O/c1-17(2)22-21(19-10-6-7-11-20(19)23(27)24-22)16-25-12-14-26(15-13-25)18-8-4-3-5-9-18/h3-11,17H,12-16H2,1-2H3,(H,24,27)