[4-chloranylsulfonyl-1-[(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)diazenyl]naphthalen-2-yl] benzoate

Systemtic Name: [4-chloranylsulfonyl-1-[(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)diazenyl]naphthalen-2-yl] benzoate Openeye Name: [4-chlorosulfonyl-1-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)azo]-2-naphthyl] benzoate CAS Name: benzoic acid [4-chlorosulfonyl-1-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)azo]-2-naphthalenyl] ester IUPAC Name: [4-chlorosulfonyl-1-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]naphthalen-2-yl] benzoate Traditional Name: benzoic acid [4-chlorosulfonyl-1-[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-yl)azo]-2-naphthyl] ester Formula: C27H19ClN4O5S MolecularWeight: 546.98156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1N=NC2=C(C=C(C3=CC=CC=C32)S(=O)(=O)Cl)OC(=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=O)C1N=NC2=C(C=C(C3=CC=CC=C32)S(=O)(=O)Cl)OC(=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H19ClN4O5S/c1-17-24(26(33)32(31-17)19-12-6-3-7-13-19)29-30-25-21-15-9-8-14-20(21)23(38(28,35)36)16-22(25)37-27(34)18-10-4-2-5-11-18/h2-16,24H,1H3