[4-(1,3-benzothiazol-2-yl)-2-chloranyl-6-methoxy-phenyl] benzoate

Systemtic Name: [4-(1,3-benzothiazol-2-yl)-2-chloranyl-6-methoxy-phenyl] benzoate Openeye Name: [4-(1,3-benzothiazol-2-yl)-2-chloro-6-methoxy-phenyl] benzoate CAS Name: benzoic acid [4-(1,3-benzothiazol-2-yl)-2-chloro-6-methoxyphenyl] ester IUPAC Name: [4-(1,3-benzothiazol-2-yl)-2-chloro-6-methoxyphenyl] benzoate Traditional Name: benzoic acid [4-(1,3-benzothiazol-2-yl)-2-chloro-6-methoxy-phenyl] ester Formula: C21H14ClNO3S MolecularWeight: 395.85876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2=NC3=CC=CC=C3S2)Cl)OC(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=C(C(=CC(=C1)C2=NC3=CC=CC=C3S2)Cl)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H14ClNO3S/c1-25-17-12-14(20-23-16-9-5-6-10-18(16)27-20)11-15(22)19(17)26-21(24)13-7-3-2-4-8-13/h2-12H,1H3