3,4-dimethoxy-N-[3-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]benzamide

Systemtic Name: 3,4-dimethoxy-N-[3-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]benzamide Openeye Name: 3,4-dimethoxy-N-[3-[2-(4-nitroanilino)-2-oxo-ethyl]sulfanylphenyl]benzamide CAS Name: 3,4-dimethoxy-N-[3-[[2-(4-nitroanilino)-2-oxoethyl]thio]phenyl]benzamide IUPAC Name: 3,4-dimethoxy-N-[3-[2-(4-nitroanilino)-2-oxoethyl]sulfanylphenyl]benzamide Traditional Name: N-[3-[[2-keto-2-(4-nitroanilino)ethyl]thio]phenyl]-3,4-dimethoxy-benzamide Formula: C23H21N3O6S MolecularWeight: 467.49434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)SCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)SCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C23H21N3O6S/c1-31-20-11-6-15(12-21(20)32-2)23(28)25-17-4-3-5-19(13-17)33-14-22(27)24-16-7-9-18(10-8-16)26(29)30/h3-13H,14H2,1-2H3,(H,24,27)(H,25,28)