4,4-dimethyl-2-[2-(3-methyl-4-phenyl-piperazin-1-yl)ethyl]isoquinoline-1,3-dione

Systemtic Name: 4,4-dimethyl-2-[2-(3-methyl-4-phenyl-piperazin-1-yl)ethyl]isoquinoline-1,3-dione Openeye Name: 4,4-dimethyl-2-[2-(3-methyl-4-phenyl-piperazin-1-yl)ethyl]isoquinoline-1,3-dione CAS Name: 4,4-dimethyl-2-[2-(3-methyl-4-phenyl-1-piperazinyl)ethyl]isoquinoline-1,3-dione IUPAC Name: 4,4-dimethyl-2-[2-(3-methyl-4-phenylpiperazin-1-yl)ethyl]isoquinoline-1,3-dione Traditional Name: 4,4-dimethyl-2-[2-(3-methyl-4-phenyl-piperazino)ethyl]isoquinoline-1,3-quinone Formula: C24H29N3O2 MolecularWeight: 391.50596

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=CC=C2)CCN3C(=O)C4=CC=CC=C4C(C3=O)(C)C

Isomeric SMILES

CC1CN(CCN1C2=CC=CC=C2)CCN3C(=O)C4=CC=CC=C4C(C3=O)(C)C

InChI

InChI=1S/C24H29N3O2/c1-18-17-25(13-15-26(18)19-9-5-4-6-10-19)14-16-27-22(28)20-11-7-8-12-21(20)24(2,3)23(27)29/h4-12,18H,13-17H2,1-3H3