methyl 4-[(1-chloranylbenzo[e][1]benzothiol-2-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-[(1-chloranylbenzo[e][1]benzothiol-2-yl)carbonylamino]benzoate Openeye Name: methyl 4-[(1-chlorobenzo[e]benzothiophene-2-carbonyl)amino]benzoate CAS Name: 4-[[(1-chloro-2-benzo[e][1]benzothiolyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(1-chlorobenzo[e][1]benzothiole-2-carbonyl)amino]benzoate Traditional Name: 4-[(1-chlorobenzo[e]benzothiophene-2-carbonyl)amino]benzoic acid methyl ester Formula: C21H14ClNO3S MolecularWeight: 395.85876

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)C=CC4=CC=CC=C43)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)C=CC4=CC=CC=C43)Cl

InChI

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