methyl 4-[[(4,5,7-trimethyl-6-oxidanyl-1,3-benzothiazol-2-yl)amino]methyl]benzoate

Systemtic Name: methyl 4-[[(4,5,7-trimethyl-6-oxidanyl-1,3-benzothiazol-2-yl)amino]methyl]benzoate Openeye Name: methyl 4-[[(6-hydroxy-4,5,7-trimethyl-1,3-benzothiazol-2-yl)amino]methyl]benzoate CAS Name: 4-[[(6-hydroxy-4,5,7-trimethyl-1,3-benzothiazol-2-yl)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(6-hydroxy-4,5,7-trimethyl-1,3-benzothiazol-2-yl)amino]methyl]benzoate Traditional Name: 4-[[(6-hydroxy-4,5,7-trimethyl-1,3-benzothiazol-2-yl)amino]methyl]benzoic acid methyl ester Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1N=C(S2)NCC3=CC=C(C=C3)C(=O)OC)C)O)C

Isomeric SMILES

CC1=C(C(=C(C2=C1N=C(S2)NCC3=CC=C(C=C3)C(=O)OC)C)O)C

InChI

InChI=1S/C19H20N2O3S/c1-10-11(2)16(22)12(3)17-15(10)21-19(25-17)20-9-13-5-7-14(8-6-13)18(23)24-4/h5-8,22H,9H2,1-4H3,(H,20,21)