2-[4-methoxy-3-[4-[(4-methoxy-2-nitro-phenyl)diazenyl]-3-methyl-5-oxidanylidene-4H-pyrazol-1-yl]phenyl]sulfonylethyl ethanoate

Systemtic Name: 2-[4-methoxy-3-[4-[(4-methoxy-2-nitro-phenyl)diazenyl]-3-methyl-5-oxidanylidene-4H-pyrazol-1-yl]phenyl]sulfonylethyl ethanoate Openeye Name: 2-[4-methoxy-3-[4-(4-methoxy-2-nitro-phenyl)azo-3-methyl-5-oxo-4H-pyrazol-1-yl]phenyl]sulfonylethyl acetate CAS Name: acetic acid 2-[4-methoxy-3-[4-(4-methoxy-2-nitrophenyl)azo-3-methyl-5-oxo-4H-pyrazol-1-yl]phenyl]sulfonylethyl ester IUPAC Name: 2-[4-methoxy-3-[4-[(4-methoxy-2-nitrophenyl)diazenyl]-3-methyl-5-oxo-4H-pyrazol-1-yl]phenyl]sulfonylethyl acetate Traditional Name: acetic acid 2-[3-[5-keto-4-(4-methoxy-2-nitro-phenyl)azo-3-methyl-2-pyrazolin-1-yl]-4-methoxy-phenyl]sulfonylethyl ester Formula: C22H23N5O9S MolecularWeight: 533.51112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1N=NC2=C(C=C(C=C2)OC)[N+](=O)[O-])C3=C(C=CC(=C3)S(=O)(=O)CCOC(=O)C)OC

Isomeric SMILES

CC1=NN(C(=O)C1N=NC2=C(C=C(C=C2)OC)[N+](=O)[O-])C3=C(C=CC(=C3)S(=O)(=O)CCOC(=O)C)OC

InChI

InChI=1S/C22H23N5O9S/c1-13-21(24-23-17-7-5-15(34-3)11-18(17)27(30)31)22(29)26(25-13)19-12-16(6-8-20(19)35-4)37(32,33)10-9-36-14(2)28/h5-8,11-12,21H,9-10H2,1-4H3