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4-[ethyl-[4-[(2-methylsulfonyl-4-nitro-phenyl)diazenyl]phenyl]amino]butanoate

4-[ethyl-[4-[(2-methylsulfonyl-4-nitro-phenyl)diazenyl]phenyl]amino]butanoate

Systemtic Name:4-[ethyl-[4-[(2-methylsulfonyl-4-nitro-phenyl)diazenyl]phenyl]amino]butanoate
Openeye Name:4-[N-ethyl-4-(2-methylsulfonyl-4-nitro-phenyl)azo-anilino]butanoate
CAS Name:4-[N-ethyl-4-(2-methylsulfonyl-4-nitrophenyl)azoanilino]butanoate
IUPAC Name:4-[N-ethyl-4-[(2-methylsulfonyl-4-nitrophenyl)diazenyl]anilino]butanoate
Traditional Name:4-[N-ethyl-4-(2-mesyl-4-nitro-phenyl)azo-anilino]butyrate
Formula: C19H21N4O6S-
MolecularWeight: 433.45824
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCC(=O)[O-])C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)C


Isomeric SMILES

CCN(CCCC(=O)[O-])C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)C


InChI

InChI=1S/C19H22N4O6S/c1-3-22(12-4-5-19(24)25)15-8-6-14(7-9-15)20-21-17-11-10-16(23(26)27)13-18(17)30(2,28)29/h6-11,13H,3-5,12H2,1-2H3,(H,24,25)/p-1


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