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

Systemtic Name: [2-[(3-chlorophenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl 4-chloranyl-3-nitro-benzoate Openeye Name: [2-(N-acetyl-3-chloro-anilino)thiazol-4-yl]methyl 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid [2-(N-acetyl-3-chloroanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-3-chloroanilino)-1,3-thiazol-4-yl]methyl 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid [2-(N-acetyl-3-chloro-anilino)thiazol-4-yl]methyl ester Formula: C19H13Cl2N3O5S MolecularWeight: 466.29462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H13Cl2N3O5S/c1-11(25)23(15-4-2-3-13(20)8-15)19-22-14(10-30-19)9-29-18(26)12-5-6-16(21)17(7-12)24(27)28/h2-8,10H,9H2,1H3