ethanedioic acid; 2-methylpropyl 2-[4-(diphenylmethyl)piperidin-1-yl]ethanoate

Systemtic Name: ethanedioic acid; 2-methylpropyl 2-[4-(diphenylmethyl)piperidin-1-yl]ethanoate Openeye Name: isobutyl 2-(4-benzhydryl-1-piperidyl)acetate; oxalic acid CAS Name: 2-[4-(diphenylmethyl)-1-piperidinyl]acetic acid 2-methylpropyl ester; oxalic acid IUPAC Name: 2-methylpropyl 2-(4-benzhydrylpiperidin-1-yl)acetate; oxalic acid Traditional Name: 2-(4-benzhydrylpiperidino)acetic acid isobutyl ester; oxalic acid Formula: C26H33NO6 MolecularWeight: 455.54332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)CN1CCC(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)COC(=O)CN1CCC(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H31NO2.C2H2O4/c1-19(2)18-27-23(26)17-25-15-13-22(14-16-25)24(20-9-5-3-6-10-20)21-11-7-4-8-12-21;3-1(4)2(5)6/h3-12,19,22,24H,13-18H2,1-2H3;(H,3,4)(H,5,6)