2-[2-[(3-nitro-4-oxidanyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-phenyl-ethanamide

Systemtic Name: 2-[2-[(3-nitro-4-oxidanyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-phenyl-ethanamide Openeye Name: 2-[2-(4-hydroxy-3-nitro-anilino)-2-oxo-ethyl]sulfanyl-N-phenyl-acetamide CAS Name: 2-[[2-(4-hydroxy-3-nitroanilino)-2-oxoethyl]thio]-N-phenylacetamide IUPAC Name: 2-[2-(4-hydroxy-3-nitroanilino)-2-oxoethyl]sulfanyl-N-phenylacetamide Traditional Name: 2-[[2-(4-hydroxy-3-nitro-anilino)-2-keto-ethyl]thio]-N-phenyl-acetamide Formula: C16H15N3O5S MolecularWeight: 361.3724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CSCC(=O)NC2=CC(=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CSCC(=O)NC2=CC(=C(C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O5S/c20-14-7-6-12(8-13(14)19(23)24)18-16(22)10-25-9-15(21)17-11-4-2-1-3-5-11/h1-8,20H,9-10H2,(H,17,21)(H,18,22)