ethanedioic acid; N-[(2-methoxyphenyl)methyl]-N-[3-(2-methylpropoxy)-2-pyrrolidin-1-yl-propyl]aniline

Systemtic Name: ethanedioic acid; N-[(2-methoxyphenyl)methyl]-N-[3-(2-methylpropoxy)-2-pyrrolidin-1-yl-propyl]aniline Openeye Name: N-(3-isobutoxy-2-pyrrolidin-1-yl-propyl)-N-[(2-methoxyphenyl)methyl]aniline; oxalic acid CAS Name: N-[(2-methoxyphenyl)methyl]-N-[3-(2-methylpropoxy)-2-(1-pyrrolidinyl)propyl]aniline; oxalic acid IUPAC Name: N-[(2-methoxyphenyl)methyl]-N-[3-(2-methylpropoxy)-2-pyrrolidin-1-ylpropyl]aniline; oxalic acid Traditional Name: (3-isobutoxy-2-pyrrolidino-propyl)-o-anisyl-phenyl-amine; oxalic acid Formula: C27H38N2O6 MolecularWeight: 486.60042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCC(CN(CC1=CC=CC=C1OC)C2=CC=CC=C2)N3CCCC3.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)COCC(CN(CC1=CC=CC=C1OC)C2=CC=CC=C2)N3CCCC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H36N2O2.C2H2O4/c1-21(2)19-29-20-24(26-15-9-10-16-26)18-27(23-12-5-4-6-13-23)17-22-11-7-8-14-25(22)28-3;3-1(4)2(5)6/h4-8,11-14,21,24H,9-10,15-20H2,1-3H3;(H,3,4)(H,5,6)