2-methyl-4-[4-(phenylmethyl)piperazin-1-yl]carbonyl-isoquinolin-1-one

Systemtic Name: 2-methyl-4-[4-(phenylmethyl)piperazin-1-yl]carbonyl-isoquinolin-1-one Openeye Name: 4-(4-benzylpiperazine-1-carbonyl)-2-methyl-isoquinolin-1-one CAS Name: 2-methyl-4-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-1-isoquinolinone IUPAC Name: 4-(4-benzylpiperazine-1-carbonyl)-2-methylisoquinolin-1-one Traditional Name: 4-(4-benzylpiperazine-1-carbonyl)-2-methyl-isocarbostyril Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C2C1=O)C(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CN1C=C(C2=CC=CC=C2C1=O)C(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H23N3O2/c1-23-16-20(18-9-5-6-10-19(18)21(23)26)22(27)25-13-11-24(12-14-25)15-17-7-3-2-4-8-17/h2-10,16H,11-15H2,1H3