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

Systemtic Name: [2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl 2-chloranyl-4-nitro-benzoate Openeye Name: [2-(4-methoxyphenyl)thiazol-4-yl]methyl 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-nitrobenzoic acid [2-(4-methoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-nitro-benzoic acid [2-(4-methoxyphenyl)thiazol-4-yl]methyl ester Formula: C18H13ClN2O5S MolecularWeight: 404.82422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H13ClN2O5S/c1-25-14-5-2-11(3-6-14)17-20-12(10-27-17)9-26-18(22)15-7-4-13(21(23)24)8-16(15)19/h2-8,10H,9H2,1H3