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

Systemtic Name: [2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl 3-methyl-2-nitro-benzoate Openeye Name: [2-(4-methoxyphenyl)thiazol-4-yl]methyl 3-methyl-2-nitro-benzoate CAS Name: 3-methyl-2-nitrobenzoic acid [2-(4-methoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl 3-methyl-2-nitrobenzoate Traditional Name: 3-methyl-2-nitro-benzoic acid [2-(4-methoxyphenyl)thiazol-4-yl]methyl ester Formula: C19H16N2O5S MolecularWeight: 384.40574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16N2O5S/c1-12-4-3-5-16(17(12)21(23)24)19(22)26-10-14-11-27-18(20-14)13-6-8-15(25-2)9-7-13/h3-9,11H,10H2,1-2H3