ethyl 2-[2-[2-[(4-nitrophenyl)amino]ethylamino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-[2-[(4-nitrophenyl)amino]ethylamino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-[2-(4-nitroanilino)ethylamino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[2-(4-nitroanilino)ethylamino]-2-oxoethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(4-nitroanilino)ethylamino]-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-[2-(4-nitroanilino)ethylamino]ethyl]thio]acetic acid ethyl ester Formula: C14H19N3O5S MolecularWeight: 341.38276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC(=O)NCCNC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CSCC(=O)NCCNC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O5S/c1-2-22-14(19)10-23-9-13(18)16-8-7-15-11-3-5-12(6-4-11)17(20)21/h3-6,15H,2,7-10H2,1H3,(H,16,18)