methyl 4-(5-chloranyl-6-nitro-1,3-benzothiazol-2-yl)benzoate

Systemtic Name: methyl 4-(5-chloranyl-6-nitro-1,3-benzothiazol-2-yl)benzoate Openeye Name: methyl 4-(5-chloro-6-nitro-1,3-benzothiazol-2-yl)benzoate CAS Name: 4-(5-chloro-6-nitro-1,3-benzothiazol-2-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(5-chloro-6-nitro-1,3-benzothiazol-2-yl)benzoate Traditional Name: 4-(5-chloro-6-nitro-1,3-benzothiazol-2-yl)benzoic acid methyl ester Formula: C15H9ClN2O4S MolecularWeight: 348.76096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=NC3=CC(=C(C=C3S2)[N+](=O)[O-])Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=NC3=CC(=C(C=C3S2)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H9ClN2O4S/c1-22-15(19)9-4-2-8(3-5-9)14-17-11-6-10(16)12(18(20)21)7-13(11)23-14/h2-7H,1H3