3-nitro-4-[2-[(6-oxidanylidene-4-propoxy-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]benzenesulfonamide

Systemtic Name: 3-nitro-4-[2-[(6-oxidanylidene-4-propoxy-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]benzenesulfonamide Openeye Name: 3-nitro-4-[2-[(6-oxo-4-propoxy-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazino]benzenesulfonamide CAS Name: 3-nitro-4-[(6-oxo-4-propoxy-1-cyclohexa-2,4-dienylidene)methylhydrazo]benzenesulfonamide IUPAC Name: 3-nitro-4-[2-[(6-oxo-4-propoxycyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]benzenesulfonamide Traditional Name: 4-[N'-[(6-keto-4-propoxy-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazino]-3-nitro-benzenesulfonamide Formula: C16H18N4O6S MolecularWeight: 394.40232

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=O)C(=CNNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])C=C1

Isomeric SMILES

CCCOC1=CC(=O)C(=CNNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])C=C1

InChI

InChI=1S/C16H18N4O6S/c1-2-7-26-12-4-3-11(16(21)8-12)10-18-19-14-6-5-13(27(17,24)25)9-15(14)20(22)23/h3-6,8-10,18-19H,2,7H2,1H3,(H2,17,24,25)