4,6-dimethyl-2-[2-oxidanyl-3-(4-phenylpiperazin-1-yl)propyl]-5-phenyl-pyrrolo[3,4-c]pyrrole-1,3-dione

Systemtic Name: 4,6-dimethyl-2-[2-oxidanyl-3-(4-phenylpiperazin-1-yl)propyl]-5-phenyl-pyrrolo[3,4-c]pyrrole-1,3-dione Openeye Name: 2-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propyl]-4,6-dimethyl-5-phenyl-pyrrolo[3,4-c]pyrrole-1,3-dione CAS Name: 2-[2-hydroxy-3-(4-phenyl-1-piperazinyl)propyl]-4,6-dimethyl-5-phenylpyrrolo[3,4-c]pyrrole-1,3-dione IUPAC Name: 2-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propyl]-4,6-dimethyl-5-phenylpyrrolo[3,4-c]pyrrole-1,3-dione Traditional Name: 2-[2-hydroxy-3-(4-phenylpiperazino)propyl]-4,6-dimethyl-5-phenyl-pyrrolo[3,4-c]pyrrole-1,3-quinone Formula: C27H30N4O3 MolecularWeight: 458.5521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(N1C3=CC=CC=C3)C)C(=O)N(C2=O)CC(CN4CCN(CC4)C5=CC=CC=C5)O

Isomeric SMILES

CC1=C2C(=C(N1C3=CC=CC=C3)C)C(=O)N(C2=O)CC(CN4CCN(CC4)C5=CC=CC=C5)O

InChI

InChI=1S/C27H30N4O3/c1-19-24-25(20(2)31(19)22-11-7-4-8-12-22)27(34)30(26(24)33)18-23(32)17-28-13-15-29(16-14-28)21-9-5-3-6-10-21/h3-12,23,32H,13-18H2,1-2H3