methyl 4-chloranyl-3-[[4-(1,3-dithiolan-2-yl)phenyl]carbonylamino]benzoate

Systemtic Name: methyl 4-chloranyl-3-[[4-(1,3-dithiolan-2-yl)phenyl]carbonylamino]benzoate Openeye Name: methyl 4-chloro-3-[[4-(1,3-dithiolan-2-yl)benzoyl]amino]benzoate CAS Name: 4-chloro-3-[[[4-(1,3-dithiolan-2-yl)phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[[4-(1,3-dithiolan-2-yl)benzoyl]amino]benzoate Traditional Name: 4-chloro-3-[[4-(1,3-dithiolan-2-yl)benzoyl]amino]benzoic acid methyl ester Formula: C18H16ClNO3S2 MolecularWeight: 393.90754

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2=CC=C(C=C2)C3SCCS3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2=CC=C(C=C2)C3SCCS3

InChI

InChI=1S/C18H16ClNO3S2/c1-23-17(22)13-6-7-14(19)15(10-13)20-16(21)11-2-4-12(5-3-11)18-24-8-9-25-18/h2-7,10,18H,8-9H2,1H3,(H,20,21)