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

Systemtic Name: [2-[(4-methoxyphenyl)amino]-1,3-thiazol-4-yl]methyl 4-methoxy-3-nitro-benzoate Openeye Name: [2-(4-methoxyanilino)thiazol-4-yl]methyl 4-methoxy-3-nitro-benzoate CAS Name: 4-methoxy-3-nitrobenzoic acid [2-(4-methoxyanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methoxyanilino)-1,3-thiazol-4-yl]methyl 4-methoxy-3-nitrobenzoate Traditional Name: 4-methoxy-3-nitro-benzoic acid [2-(p-anisidino)thiazol-4-yl]methyl ester Formula: C19H17N3O6S MolecularWeight: 415.41978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC(=CS2)COC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC(=CS2)COC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O6S/c1-26-15-6-4-13(5-7-15)20-19-21-14(11-29-19)10-28-18(23)12-3-8-17(27-2)16(9-12)22(24)25/h3-9,11H,10H2,1-2H3,(H,20,21)