methyl 7-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]heptanoate

Systemtic Name: methyl 7-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]heptanoate Openeye Name: methyl 7-[(3-chlorobenzothiophene-2-carbonyl)amino]heptanoate CAS Name: 7-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 7-[(3-chloro-1-benzothiophene-2-carbonyl)amino]heptanoate Traditional Name: 7-[(3-chlorobenzothiophene-2-carbonyl)amino]enanthic acid methyl ester Formula: C17H20ClNO3S MolecularWeight: 353.8636

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCNC(=O)C1=C(C2=CC=CC=C2S1)Cl

Isomeric SMILES

COC(=O)CCCCCCNC(=O)C1=C(C2=CC=CC=C2S1)Cl

InChI

InChI=1S/C17H20ClNO3S/c1-22-14(20)10-4-2-3-7-11-19-17(21)16-15(18)12-8-5-6-9-13(12)23-16/h5-6,8-9H,2-4,7,10-11H2,1H3,(H,19,21)