2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-(3-methylphenyl)amino]ethyl benzoate

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-(3-methylphenyl)amino]ethyl benzoate Openeye Name: 2-(N-(1,1-dioxo-1,2-benzothiazol-3-yl)-3-methyl-anilino)ethyl benzoate CAS Name: benzoic acid 2-(N-(1,1-dioxo-1,2-benzothiazol-3-yl)-3-methylanilino)ethyl ester IUPAC Name: 2-(N-(1,1-dioxo-1,2-benzothiazol-3-yl)-3-methylanilino)ethyl benzoate Traditional Name: benzoic acid 2-(N-(1,1-diketo-1,2-benzothiazol-3-yl)-3-methyl-anilino)ethyl ester Formula: C23H20N2O4S MolecularWeight: 420.4809

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CCOC(=O)C2=CC=CC=C2)C3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

CC1=CC(=CC=C1)N(CCOC(=O)C2=CC=CC=C2)C3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C23H20N2O4S/c1-17-8-7-11-19(16-17)25(14-15-29-23(26)18-9-3-2-4-10-18)22-20-12-5-6-13-21(20)30(27,28)24-22/h2-13,16H,14-15H2,1H3