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

Systemtic Name: [2-[(4-methoxyphenyl)amino]-1,3-thiazol-4-yl]methyl 4-methyl-3-nitro-benzoate Openeye Name: [2-(4-methoxyanilino)thiazol-4-yl]methyl 4-methyl-3-nitro-benzoate CAS Name: 4-methyl-3-nitrobenzoic acid [2-(4-methoxyanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methoxyanilino)-1,3-thiazol-4-yl]methyl 4-methyl-3-nitrobenzoate Traditional Name: 4-methyl-3-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=C(C=C1)C(=O)OCC2=CSC(=N2)NC3=CC=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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