[2-[(4-methoxyphenyl)amino]-1,3-thiazol-4-yl]methyl 2-methyl-6-nitro-benzoate

Systemtic Name: [2-[(4-methoxyphenyl)amino]-1,3-thiazol-4-yl]methyl 2-methyl-6-nitro-benzoate Openeye Name: [2-(4-methoxyanilino)thiazol-4-yl]methyl 2-methyl-6-nitro-benzoate CAS Name: 2-methyl-6-nitrobenzoic acid [2-(4-methoxyanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methoxyanilino)-1,3-thiazol-4-yl]methyl 2-methyl-6-nitrobenzoate Traditional Name: 2-methyl-6-nitro-benzoic acid [2-(p-anisidino)thiazol-4-yl]methyl ester Formula: C19H17N3O5S MolecularWeight: 399.42038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)OCC2=CSC(=N2)NC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)OCC2=CSC(=N2)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C19H17N3O5S/c1-12-4-3-5-16(22(24)25)17(12)18(23)27-10-14-11-28-19(21-14)20-13-6-8-15(26-2)9-7-13/h3-9,11H,10H2,1-2H3,(H,20,21)