(4E)-5-(2,4-dimethoxyphenyl)-1-hexadecyl-4-[(4-nitrophenyl)-oxidanyl-methylidene]pyrrolidine-2,3-dione

Systemtic Name: (4E)-5-(2,4-dimethoxyphenyl)-1-hexadecyl-4-[(4-nitrophenyl)-oxidanyl-methylidene]pyrrolidine-2,3-dione Openeye Name: (4E)-5-(2,4-dimethoxyphenyl)-1-hexadecyl-4-[hydroxy-(4-nitrophenyl)methylene]pyrrolidine-2,3-dione CAS Name: (4E)-5-(2,4-dimethoxyphenyl)-1-hexadecyl-4-[hydroxy-(4-nitrophenyl)methylidene]pyrrolidine-2,3-dione IUPAC Name: (4E)-5-(2,4-dimethoxyphenyl)-1-hexadecyl-4-[hydroxy-(4-nitrophenyl)methylidene]pyrrolidine-2,3-dione Traditional Name: (4E)-1-cetyl-5-(2,4-dimethoxyphenyl)-4-[hydroxy-(4-nitrophenyl)methylene]pyrrolidine-2,3-quinone Formula: C35H48N2O7 MolecularWeight: 608.76482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1C(C(=C(C2=CC=C(C=C2)[N+](=O)[O-])O)C(=O)C1=O)C3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCN1C(/C(=C(/C2=CC=C(C=C2)[N+](=O)[O-])\O)/C(=O)C1=O)C3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C35H48N2O7/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-36-32(29-23-22-28(43-2)25-30(29)44-3)31(34(39)35(36)40)33(38)26-18-20-27(21-19-26)37(41)42/h18-23,25,32,38H,4-17,24H2,1-3H3/b33-31+