phenylazanyl 3-chloranyl-4-[[3-(2-methylphenyl)-3-oxidanylidene-propanoyl]amino]benzenesulfinate

Systemtic Name: phenylazanyl 3-chloranyl-4-[[3-(2-methylphenyl)-3-oxidanylidene-propanoyl]amino]benzenesulfinate Openeye Name: anilino 3-chloro-4-[[3-(o-tolyl)-3-oxo-propanoyl]amino]benzenesulfinate CAS Name: 3-chloro-4-[[3-(2-methylphenyl)-1,3-dioxopropyl]amino]benzenesulfinic acid anilino ester IUPAC Name: anilino 3-chloro-4-[[3-(2-methylphenyl)-3-oxopropanoyl]amino]benzenesulfinate Traditional Name: 3-chloro-4-[[3-keto-3-(o-tolyl)propanoyl]amino]benzenesulfinic acid anilino ester Formula: C22H19ClN2O4S MolecularWeight: 442.91526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)CC(=O)NC2=C(C=C(C=C2)S(=O)ONC3=CC=CC=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)CC(=O)NC2=C(C=C(C=C2)S(=O)ONC3=CC=CC=C3)Cl

InChI

InChI=1S/C22H19ClN2O4S/c1-15-7-5-6-10-18(15)21(26)14-22(27)24-20-12-11-17(13-19(20)23)30(28)29-25-16-8-3-2-4-9-16/h2-13,25H,14H2,1H3,(H,24,27)