[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 5-chloranyl-2-nitro-benzoate

Systemtic Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 5-chloranyl-2-nitro-benzoate Openeye Name: [2-(p-tolyl)thiazol-4-yl]methyl 5-chloro-2-nitro-benzoate CAS Name: 5-chloro-2-nitrobenzoic acid [2-(4-methylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 5-chloro-2-nitrobenzoate Traditional Name: 5-chloro-2-nitro-benzoic acid [2-(p-tolyl)thiazol-4-yl]methyl ester Formula: C18H13ClN2O4S MolecularWeight: 388.82482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H13ClN2O4S/c1-11-2-4-12(5-3-11)17-20-14(10-26-17)9-25-18(22)15-8-13(19)6-7-16(15)21(23)24/h2-8,10H,9H2,1H3