2-(4-chlorophenyl)-4-(4-ethylpiperazin-1-yl)carbonyl-isoquinolin-1-one

Systemtic Name: 2-(4-chlorophenyl)-4-(4-ethylpiperazin-1-yl)carbonyl-isoquinolin-1-one Openeye Name: 2-(4-chlorophenyl)-4-(4-ethylpiperazine-1-carbonyl)isoquinolin-1-one CAS Name: 2-(4-chlorophenyl)-4-[(4-ethyl-1-piperazinyl)-oxomethyl]-1-isoquinolinone IUPAC Name: 2-(4-chlorophenyl)-4-(4-ethylpiperazine-1-carbonyl)isoquinolin-1-one Traditional Name: 2-(4-chlorophenyl)-4-(4-ethylpiperazine-1-carbonyl)isocarbostyril Formula: C22H22ClN3O2 MolecularWeight: 395.88198

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H22ClN3O2/c1-2-24-11-13-25(14-12-24)21(27)20-15-26(17-9-7-16(23)8-10-17)22(28)19-6-4-3-5-18(19)20/h3-10,15H,2,11-14H2,1H3