ethanedioic acid; N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-1-benzothiophene-2-carboxamide

Systemtic Name: ethanedioic acid; N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-1-benzothiophene-2-carboxamide Openeye Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-benzothiophene-2-carboxamide; oxalic acid CAS Name: N-[(1-ethyl-2-pyrrolidinyl)methyl]-3-methoxy-1-benzothiophene-2-carboxamide; oxalic acid IUPAC Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-1-benzothiophene-2-carboxamide; oxalic acid Traditional Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-benzothiophene-2-carboxamide; oxalic acid Formula: C19H24N2O6S MolecularWeight: 408.46866

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC(=O)C2=C(C3=CC=CC=C3S2)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCCC1CNC(=O)C2=C(C3=CC=CC=C3S2)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H22N2O2S.C2H2O4/c1-3-19-10-6-7-12(19)11-18-17(20)16-15(21-2)13-8-4-5-9-14(13)22-16;3-1(4)2(5)6/h4-5,8-9,12H,3,6-7,10-11H2,1-2H3,(H,18,20);(H,3,4)(H,5,6)