2-oxidanylpropane-1,2,3-tricarboxylate; N-phenylmethoxy-N-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]ethanamide

Systemtic Name: 2-oxidanylpropane-1,2,3-tricarboxylate; N-phenylmethoxy-N-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]ethanamide Openeye Name: N-benzyloxy-N-[1-[2-(2-thienyl)ethyl]-4-piperidyl]acetamide citrate CAS Name: 2-hydroxypropane-1,2,3-tricarboxylate; N-phenylmethoxy-N-[1-(2-thiophen-2-ylethyl)-4-piperidinyl]acetamide IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylate; N-phenylmethoxy-N-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]acetamide Traditional Name: N-benzoxy-N-[1-[2-(2-thienyl)ethyl]-4-piperidyl]acetamide citrate Formula: C26H31N2O9S-3 MolecularWeight: 547.59734

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1CCN(CC1)CCC2=CC=CS2)OCC3=CC=CC=C3.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

CC(=O)N(C1CCN(CC1)CCC2=CC=CS2)OCC3=CC=CC=C3.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

InChI

InChI=1S/C20H26N2O2S.C6H8O7/c1-17(23)22(24-16-18-6-3-2-4-7-18)19-9-12-21(13-10-19)14-11-20-8-5-15-25-20;7-3(8)1-6(13,5(11)12)2-4(9)10/h2-8,15,19H,9-14,16H2,1H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/p-3