2-[2-[(4-dimethylaminophenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoic acid

Systemtic Name: 2-[2-[(4-dimethylaminophenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoic acid Openeye Name: 2-[2-[4-(dimethylamino)anilino]-2-oxo-ethyl]sulfanylbenzoic acid CAS Name: 2-[[2-[4-(dimethylamino)anilino]-2-oxoethyl]thio]benzoic acid IUPAC Name: 2-[2-[4-(dimethylamino)anilino]-2-oxoethyl]sulfanylbenzoic acid Traditional Name: 2-[[2-[4-(dimethylamino)anilino]-2-keto-ethyl]thio]benzoic acid Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC(=O)CSC2=CC=CC=C2C(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=O)CSC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C17H18N2O3S/c1-19(2)13-9-7-12(8-10-13)18-16(20)11-23-15-6-4-3-5-14(15)17(21)22/h3-10H,11H2,1-2H3,(H,18,20)(H,21,22)