(2-methoxy-5-methyl-phenyl)methyl 4-chloranyl-2-(thiophen-2-ylcarbonylamino)benzoate

Systemtic Name: (2-methoxy-5-methyl-phenyl)methyl 4-chloranyl-2-(thiophen-2-ylcarbonylamino)benzoate Openeye Name: (2-methoxy-5-methyl-phenyl)methyl 4-chloro-2-(thiophene-2-carbonylamino)benzoate CAS Name: 4-chloro-2-[[oxo(thiophen-2-yl)methyl]amino]benzoic acid (2-methoxy-5-methylphenyl)methyl ester IUPAC Name: (2-methoxy-5-methylphenyl)methyl 4-chloro-2-(thiophene-2-carbonylamino)benzoate Traditional Name: 4-chloro-2-(2-thenoylamino)benzoic acid (2-methoxy-5-methyl-benzyl) ester Formula: C21H18ClNO4S MolecularWeight: 415.88992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)COC(=O)C2=C(C=C(C=C2)Cl)NC(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)COC(=O)C2=C(C=C(C=C2)Cl)NC(=O)C3=CC=CS3

InChI

InChI=1S/C21H18ClNO4S/c1-13-5-8-18(26-2)14(10-13)12-27-21(25)16-7-6-15(22)11-17(16)23-20(24)19-4-3-9-28-19/h3-11H,12H2,1-2H3,(H,23,24)