N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-2-(3-nitrophenoxy)ethanamide

Systemtic Name: N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-2-(3-nitrophenoxy)ethanamide Openeye Name: N-[2-(2-amino-2-oxo-ethyl)sulfanylphenyl]-2-(3-nitrophenoxy)acetamide CAS Name: N-[2-[(2-amino-2-oxoethyl)thio]phenyl]-2-(3-nitrophenoxy)acetamide IUPAC Name: N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-2-(3-nitrophenoxy)acetamide Traditional Name: N-[2-[(2-amino-2-keto-ethyl)thio]phenyl]-2-(3-nitrophenoxy)acetamide Formula: C16H15N3O5S MolecularWeight: 361.3724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)COC2=CC=CC(=C2)[N+](=O)[O-])SCC(=O)N

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)COC2=CC=CC(=C2)[N+](=O)[O-])SCC(=O)N

InChI

InChI=1S/C16H15N3O5S/c17-15(20)10-25-14-7-2-1-6-13(14)18-16(21)9-24-12-5-3-4-11(8-12)19(22)23/h1-8H,9-10H2,(H2,17,20)(H,18,21)