1-chloroethyl 2-phenacyl-2H-1,3-benzothiazole-3-carboxylate

Systemtic Name: 1-chloroethyl 2-phenacyl-2H-1,3-benzothiazole-3-carboxylate Openeye Name: 1-chloroethyl 2-phenacyl-2H-1,3-benzothiazole-3-carboxylate CAS Name: 2-phenacyl-2H-1,3-benzothiazole-3-carboxylic acid 1-chloroethyl ester IUPAC Name: 1-chloroethyl 2-phenacyl-2H-1,3-benzothiazole-3-carboxylate Traditional Name: 2-phenacyl-2H-1,3-benzothiazole-3-carboxylic acid 1-chloroethyl ester Formula: C18H16ClNO3S MolecularWeight: 361.84254

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Descriptors Computed from Structure

Canonical SMILES:

CC(OC(=O)N1C(SC2=CC=CC=C21)CC(=O)C3=CC=CC=C3)Cl

Isomeric SMILES

CC(OC(=O)N1C(SC2=CC=CC=C21)CC(=O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C18H16ClNO3S/c1-12(19)23-18(22)20-14-9-5-6-10-16(14)24-17(20)11-15(21)13-7-3-2-4-8-13/h2-10,12,17H,11H2,1H3