6-butyl-2,5,7-trimethyl-3-(phenylmethyl)pyrrolo[3,4-d]pyridazine-1,4-dione

Systemtic Name: 6-butyl-2,5,7-trimethyl-3-(phenylmethyl)pyrrolo[3,4-d]pyridazine-1,4-dione Openeye Name: 3-benzyl-6-butyl-2,5,7-trimethyl-pyrrolo[3,4-d]pyridazine-1,4-dione CAS Name: 6-butyl-2,5,7-trimethyl-3-(phenylmethyl)pyrrolo[3,4-d]pyridazine-1,4-dione IUPAC Name: 3-benzyl-6-butyl-2,5,7-trimethylpyrrolo[3,4-d]pyridazine-1,4-dione Traditional Name: 3-benzyl-6-butyl-2,5,7-trimethyl-pyrrolo[3,4-d]pyridazine-1,4-quinone Formula: C20H25N3O2 MolecularWeight: 339.4314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C2C(=C1C)C(=O)N(N(C2=O)C)CC3=CC=CC=C3)C

Isomeric SMILES

CCCCN1C(=C2C(=C1C)C(=O)N(N(C2=O)C)CC3=CC=CC=C3)C

InChI

InChI=1S/C20H25N3O2/c1-5-6-12-22-14(2)17-18(15(22)3)20(25)23(21(4)19(17)24)13-16-10-8-7-9-11-16/h7-11H,5-6,12-13H2,1-4H3