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

Systemtic Name: 3-methyl-4-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonylamino)benzoic acid Openeye Name: 3-methyl-4-(4,5,6,7-tetrahydrobenzothiophene-2-carbonylamino)benzoic acid CAS Name: 3-methyl-4-[[oxo(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methyl]amino]benzoic acid IUPAC Name: 3-methyl-4-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonylamino)benzoic acid Traditional Name: 3-methyl-4-(4,5,6,7-tetrahydrobenzothiophene-2-carbonylamino)benzoic acid Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=CC3=C(S2)CCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=CC3=C(S2)CCCC3

InChI

InChI=1S/C17H17NO3S/c1-10-8-12(17(20)21)6-7-13(10)18-16(19)15-9-11-4-2-3-5-14(11)22-15/h6-9H,2-5H2,1H3,(H,18,19)(H,20,21)