S-[(4-methylphenyl)amino] 4-ethenyl-3-nitro-2-oxidanyl-benzenecarbothioate

Systemtic Name: S-[(4-methylphenyl)amino] 4-ethenyl-3-nitro-2-oxidanyl-benzenecarbothioate Openeye Name: S-(4-methylanilino) 2-hydroxy-3-nitro-4-vinyl-benzenecarbothioate CAS Name: 4-ethenyl-2-hydroxy-3-nitrobenzenecarbothioic acid S-(4-methylanilino) ester IUPAC Name: S-(4-methylanilino) 4-ethenyl-2-hydroxy-3-nitrobenzenecarbothioate Traditional Name: 2-hydroxy-3-nitro-4-vinyl-thiobenzoic acid S-(p-toluidino) ester Formula: C16H14N2O4S MolecularWeight: 330.35836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NSC(=O)C2=C(C(=C(C=C2)C=C)[N+](=O)[O-])O

Isomeric SMILES

CC1=CC=C(C=C1)NSC(=O)C2=C(C(=C(C=C2)C=C)[N+](=O)[O-])O

InChI

InChI=1S/C16H14N2O4S/c1-3-11-6-9-13(15(19)14(11)18(21)22)16(20)23-17-12-7-4-10(2)5-8-12/h3-9,17,19H,1H2,2H3