[(Z)-1-(3-methylsulfanylthiophen-2-yl)ethylideneamino] 4-nitrobenzoate

Systemtic Name: [(Z)-1-(3-methylsulfanylthiophen-2-yl)ethylideneamino] 4-nitrobenzoate Openeye Name: [(Z)-1-(3-methylsulfanyl-2-thienyl)ethylideneamino] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(Z)-1-[3-(methylthio)-2-thiophenyl]ethylideneamino] ester IUPAC Name: [(Z)-1-(3-methylsulfanylthiophen-2-yl)ethylideneamino] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(Z)-1-[3-(methylthio)-2-thienyl]ethylideneamino] ester Formula: C14H12N2O4S2 MolecularWeight: 336.38608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(=O)C1=CC=C(C=C1)[N+](=O)[O-])C2=C(C=CS2)SC

Isomeric SMILES

C/C(=N/OC(=O)C1=CC=C(C=C1)[N+](=O)[O-])/C2=C(C=CS2)SC

InChI

InChI=1S/C14H12N2O4S2/c1-9(13-12(21-2)7-8-22-13)15-20-14(17)10-3-5-11(6-4-10)16(18)19/h3-8H,1-2H3/b15-9-