methyl 4-[[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[(3-chlorobenzothiophene-2-carbonyl)amino]methyl]benzoate CAS Name: 4-[[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]methyl]benzoate Traditional Name: 4-[[(3-chlorobenzothiophene-2-carbonyl)amino]methyl]benzoic acid methyl ester Formula: C18H14ClNO3S MolecularWeight: 359.82666

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C18H14ClNO3S/c1-23-18(22)12-8-6-11(7-9-12)10-20-17(21)16-15(19)13-4-2-3-5-14(13)24-16/h2-9H,10H2,1H3,(H,20,21)