3-butoxy-4-[2-[oxidanyl(diphenyl)methyl]pyrrolidin-1-yl]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-butoxy-4-[2-[oxidanyl(diphenyl)methyl]pyrrolidin-1-yl]cyclobut-3-ene-1,2-dione Openeye Name: 3-butoxy-4-[2-[hydroxy(diphenyl)methyl]pyrrolidin-1-yl]cyclobut-3-ene-1,2-dione CAS Name: 3-butoxy-4-[2-[hydroxy(diphenyl)methyl]-1-pyrrolidinyl]cyclobut-3-ene-1,2-dione IUPAC Name: 3-butoxy-4-[2-[hydroxy(diphenyl)methyl]pyrrolidin-1-yl]cyclobut-3-ene-1,2-dione Traditional Name: 3-butoxy-4-[2-[hydroxy(diphenyl)methyl]pyrrolidino]cyclobut-3-ene-1,2-quinone Formula: C25H27NO4 MolecularWeight: 405.48618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=O)C1=O)N2CCCC2C(C3=CC=CC=C3)(C4=CC=CC=C4)O

Isomeric SMILES

CCCCOC1=C(C(=O)C1=O)N2CCCC2C(C3=CC=CC=C3)(C4=CC=CC=C4)O

InChI

InChI=1S/C25H27NO4/c1-2-3-17-30-24-21(22(27)23(24)28)26-16-10-15-20(26)25(29,18-11-6-4-7-12-18)19-13-8-5-9-14-19/h4-9,11-14,20,29H,2-3,10,15-17H2,1H3