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

Systemtic Name: N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-4-methoxy-3-nitro-benzamide Openeye Name: N-[2-(2-amino-2-oxo-ethyl)sulfanylphenyl]-4-methoxy-3-nitro-benzamide CAS Name: N-[2-[(2-amino-2-oxoethyl)thio]phenyl]-4-methoxy-3-nitrobenzamide IUPAC Name: N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-4-methoxy-3-nitrobenzamide Traditional Name: N-[2-[(2-amino-2-keto-ethyl)thio]phenyl]-4-methoxy-3-nitro-benzamide Formula: C16H15N3O5S MolecularWeight: 361.3724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2SCC(=O)N)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2SCC(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O5S/c1-24-13-7-6-10(8-12(13)19(22)23)16(21)18-11-4-2-3-5-14(11)25-9-15(17)20/h2-8H,9H2,1H3,(H2,17,20)(H,18,21)