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

Systemtic Name: 4-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]butanoate Openeye Name: 4-[(3-chlorobenzothiophene-2-carbonyl)amino]butanoate CAS Name: 4-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]butanoate IUPAC Name: 4-[(3-chloro-1-benzothiophene-2-carbonyl)amino]butanoate Traditional Name: 4-[(3-chlorobenzothiophene-2-carbonyl)amino]butyrate Formula: C13H11ClNO3S- MolecularWeight: 296.74934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)NCCCC(=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)NCCCC(=O)[O-])Cl

InChI

InChI=1S/C13H12ClNO3S/c14-11-8-4-1-2-5-9(8)19-12(11)13(18)15-7-3-6-10(16)17/h1-2,4-5H,3,6-7H2,(H,15,18)(H,16,17)/p-1