ethanedioic acid; 2-[[2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]amino]-1-phenyl-ethanol

Systemtic Name: ethanedioic acid; 2-[[2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]amino]-1-phenyl-ethanol Openeye Name: 2-[[2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]amino]-1-phenyl-ethanol; oxalic acid CAS Name: 2-[[2-(4-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]amino]-1-phenylethanol; oxalic acid IUPAC Name: 2-[[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]amino]-1-phenylethanol; oxalic acid Traditional Name: 2-[[2-(4-methoxyphenyl)-2-pyrrolidino-ethyl]amino]-1-phenyl-ethanol; oxalic acid Formula: C23H30N2O6 MolecularWeight: 430.4941

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNCC(C2=CC=CC=C2)O)N3CCCC3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(CNCC(C2=CC=CC=C2)O)N3CCCC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H28N2O2.C2H2O4/c1-25-19-11-9-17(10-12-19)20(23-13-5-6-14-23)15-22-16-21(24)18-7-3-2-4-8-18;3-1(4)2(5)6/h2-4,7-12,20-22,24H,5-6,13-16H2,1H3;(H,3,4)(H,5,6)