4-[2-[(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[2-[(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-[2-[(3-bromo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-[(3-bromo-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylhydrazo]-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[2-[(3-bromo-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-[N'-[(3-bromo-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C18H21BrN4O6S MolecularWeight: 501.35154

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NNC=C2C=C(C(=O)C(=C2)Br)OC)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NNC=C2C=C(C(=O)C(=C2)Br)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H21BrN4O6S/c1-4-22(5-2)30(27,28)13-6-7-15(16(10-13)23(25)26)21-20-11-12-8-14(19)18(24)17(9-12)29-3/h6-11,20-21H,4-5H2,1-3H3