4-(1-benzothiophen-7-yl)-5-methyl-1,2,3,6-tetrahydropyridine; ethanedioic acid

Systemtic Name: 4-(1-benzothiophen-7-yl)-5-methyl-1,2,3,6-tetrahydropyridine; ethanedioic acid Openeye Name: 4-(benzothiophen-7-yl)-5-methyl-1,2,3,6-tetrahydropyridine; oxalic acid CAS Name: 4-(1-benzothiophen-7-yl)-5-methyl-1,2,3,6-tetrahydropyridine; oxalic acid IUPAC Name: 4-(1-benzothiophen-7-yl)-5-methyl-1,2,3,6-tetrahydropyridine; oxalic acid Traditional Name: 4-(benzothiophen-7-yl)-5-methyl-1,2,3,6-tetrahydropyridine; oxalic acid Formula: C16H17NO4S MolecularWeight: 319.37548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CCNC1)C2=CC=CC3=C2SC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(CCNC1)C2=CC=CC3=C2SC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H15NS.C2H2O4/c1-10-9-15-7-5-12(10)13-4-2-3-11-6-8-16-14(11)13;3-1(4)2(5)6/h2-4,6,8,15H,5,7,9H2,1H3;(H,3,4)(H,5,6)