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

Systemtic Name: 2-butyl-1,3-dimethyl-5-[2-(4-oxidanyl-4-phenyl-piperidin-1-yl)ethyl]pyrrolo[3,4-c]pyrrole-4,6-dione Openeye Name: 2-butyl-5-[2-(4-hydroxy-4-phenyl-1-piperidyl)ethyl]-1,3-dimethyl-pyrrolo[3,4-c]pyrrole-4,6-dione CAS Name: 2-butyl-5-[2-(4-hydroxy-4-phenyl-1-piperidinyl)ethyl]-1,3-dimethylpyrrolo[3,4-c]pyrrole-4,6-dione IUPAC Name: 2-butyl-5-[2-(4-hydroxy-4-phenylpiperidin-1-yl)ethyl]-1,3-dimethylpyrrolo[3,4-c]pyrrole-4,6-dione Traditional Name: 2-butyl-5-[2-(4-hydroxy-4-phenyl-piperidino)ethyl]-1,3-dimethyl-pyrrolo[3,4-c]pyrrole-4,6-quinone Formula: C25H33N3O3 MolecularWeight: 423.54782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C2C(=C1C)C(=O)N(C2=O)CCN3CCC(CC3)(C4=CC=CC=C4)O)C

Isomeric SMILES

CCCCN1C(=C2C(=C1C)C(=O)N(C2=O)CCN3CCC(CC3)(C4=CC=CC=C4)O)C

InChI

InChI=1S/C25H33N3O3/c1-4-5-13-27-18(2)21-22(19(27)3)24(30)28(23(21)29)17-16-26-14-11-25(31,12-15-26)20-9-7-6-8-10-20/h6-10,31H,4-5,11-17H2,1-3H3