N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-4-ethoxy-3-nitro-benzamide

Systemtic Name: N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-4-ethoxy-3-nitro-benzamide Openeye Name: N-[2-(2-amino-2-oxo-ethyl)sulfanylphenyl]-4-ethoxy-3-nitro-benzamide CAS Name: N-[2-[(2-amino-2-oxoethyl)thio]phenyl]-4-ethoxy-3-nitrobenzamide IUPAC Name: N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-4-ethoxy-3-nitrobenzamide Traditional Name: N-[2-[(2-amino-2-keto-ethyl)thio]phenyl]-4-ethoxy-3-nitro-benzamide Formula: C17H17N3O5S MolecularWeight: 375.39898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2SCC(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2SCC(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O5S/c1-2-25-14-8-7-11(9-13(14)20(23)24)17(22)19-12-5-3-4-6-15(12)26-10-16(18)21/h3-9H,2,10H2,1H3,(H2,18,21)(H,19,22)