4,4-dimethyl-2-[2-(4-phenylpiperazin-1-yl)ethyl]isoquinoline-1,3-dione

Systemtic Name: 4,4-dimethyl-2-[2-(4-phenylpiperazin-1-yl)ethyl]isoquinoline-1,3-dione Openeye Name: 4,4-dimethyl-2-[2-(4-phenylpiperazin-1-yl)ethyl]isoquinoline-1,3-dione CAS Name: 4,4-dimethyl-2-[2-(4-phenyl-1-piperazinyl)ethyl]isoquinoline-1,3-dione IUPAC Name: 4,4-dimethyl-2-[2-(4-phenylpiperazin-1-yl)ethyl]isoquinoline-1,3-dione Traditional Name: 4,4-dimethyl-2-[2-(4-phenylpiperazino)ethyl]isoquinoline-1,3-quinone Formula: C23H27N3O2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2C(=O)N(C1=O)CCN3CCN(CC3)C4=CC=CC=C4)C

Isomeric SMILES

CC1(C2=CC=CC=C2C(=O)N(C1=O)CCN3CCN(CC3)C4=CC=CC=C4)C

InChI

InChI=1S/C23H27N3O2/c1-23(2)20-11-7-6-10-19(20)21(27)26(22(23)28)17-14-24-12-15-25(16-13-24)18-8-4-3-5-9-18/h3-11H,12-17H2,1-2H3