ethanedioic acid; 1-[[1-(phenylmethyl)pyrrolidin-3-yl]amino]-3-(2-propan-2-ylphenoxy)propan-2-ol

Systemtic Name: ethanedioic acid; 1-[[1-(phenylmethyl)pyrrolidin-3-yl]amino]-3-(2-propan-2-ylphenoxy)propan-2-ol Openeye Name: 1-[(1-benzylpyrrolidin-3-yl)amino]-3-(2-isopropylphenoxy)propan-2-ol; oxalic acid CAS Name: oxalic acid; 1-[[1-(phenylmethyl)-3-pyrrolidinyl]amino]-3-(2-propan-2-ylphenoxy)-2-propanol IUPAC Name: 1-[(1-benzylpyrrolidin-3-yl)amino]-3-(2-propan-2-ylphenoxy)propan-2-ol; oxalic acid Traditional Name: 1-[(1-benzylpyrrolidin-3-yl)amino]-3-(2-isopropylphenoxy)propan-2-ol; oxalic acid Formula: C25H34N2O6 MolecularWeight: 458.54726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OCC(CNC2CCN(C2)CC3=CC=CC=C3)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)C1=CC=CC=C1OCC(CNC2CCN(C2)CC3=CC=CC=C3)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H32N2O2.C2H2O4/c1-18(2)22-10-6-7-11-23(22)27-17-21(26)14-24-20-12-13-25(16-20)15-19-8-4-3-5-9-19;3-1(4)2(5)6/h3-11,18,20-21,24,26H,12-17H2,1-2H3;(H,3,4)(H,5,6)