[2-[[1,3-bis(oxidanylidene)-1-phenylazanyl-butan-2-yl]diazenyl]-4-chloranylsulfonyl-phenyl] ethanoate

Systemtic Name: [2-[[1,3-bis(oxidanylidene)-1-phenylazanyl-butan-2-yl]diazenyl]-4-chloranylsulfonyl-phenyl] ethanoate Openeye Name: [4-chlorosulfonyl-2-[2-oxo-1-(phenylcarbamoyl)propyl]azo-phenyl] acetate CAS Name: acetic acid [2-(1-anilino-1,3-dioxobutan-2-yl)azo-4-chlorosulfonylphenyl] ester IUPAC Name: [2-[(1-anilino-1,3-dioxobutan-2-yl)diazenyl]-4-chlorosulfonylphenyl] acetate Traditional Name: acetic acid [4-chlorosulfonyl-2-[2-keto-1-(phenylcarbamoyl)propyl]azo-phenyl] ester Formula: C18H16ClN3O6S MolecularWeight: 437.85414

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)NC1=CC=CC=C1)N=NC2=C(C=CC(=C2)S(=O)(=O)Cl)OC(=O)C

Isomeric SMILES

CC(=O)C(C(=O)NC1=CC=CC=C1)N=NC2=C(C=CC(=C2)S(=O)(=O)Cl)OC(=O)C

InChI

InChI=1S/C18H16ClN3O6S/c1-11(23)17(18(25)20-13-6-4-3-5-7-13)22-21-15-10-14(29(19,26)27)8-9-16(15)28-12(2)24/h3-10,17H,1-2H3,(H,20,25)