4-chloranyl-3-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonylamino)benzoic acid

Systemtic Name: 4-chloranyl-3-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonylamino)benzoic acid Openeye Name: 4-chloro-3-(4,5,6,7-tetrahydrobenzothiophene-2-carbonylamino)benzoic acid CAS Name: 4-chloro-3-[[oxo(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methyl]amino]benzoic acid IUPAC Name: 4-chloro-3-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonylamino)benzoic acid Traditional Name: 4-chloro-3-(4,5,6,7-tetrahydrobenzothiophene-2-carbonylamino)benzoic acid Formula: C16H14ClNO3S MolecularWeight: 335.80526

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C(S2)C(=O)NC3=C(C=CC(=C3)C(=O)O)Cl

Isomeric SMILES

C1CCC2=C(C1)C=C(S2)C(=O)NC3=C(C=CC(=C3)C(=O)O)Cl

InChI

InChI=1S/C16H14ClNO3S/c17-11-6-5-10(16(20)21)7-12(11)18-15(19)14-8-9-3-1-2-4-13(9)22-14/h5-8H,1-4H2,(H,18,19)(H,20,21)