ethanedioic acid; oxan-4-yl 2-[4-(diphenylmethylidene)piperidin-1-yl]ethanoate

Systemtic Name: ethanedioic acid; oxan-4-yl 2-[4-(diphenylmethylidene)piperidin-1-yl]ethanoate Openeye Name: oxalic acid; tetrahydropyran-4-yl 2-(4-benzhydrylidene-1-piperidyl)acetate CAS Name: 2-[4-(diphenylmethylene)-1-piperidinyl]acetic acid 4-oxanyl ester; oxalic acid IUPAC Name: oxalic acid; oxan-4-yl 2-(4-benzhydrylidenepiperidin-1-yl)acetate Traditional Name: 2-(4-benzhydrylidenepiperidino)acetic acid tetrahydropyran-4-yl ester; oxalic acid Formula: C27H31NO7 MolecularWeight: 481.53754

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1OC(=O)CN2CCC(=C(C3=CC=CC=C3)C4=CC=CC=C4)CC2.C(=O)(C(=O)O)O

Isomeric SMILES

C1COCCC1OC(=O)CN2CCC(=C(C3=CC=CC=C3)C4=CC=CC=C4)CC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H29NO3.C2H2O4/c27-24(29-23-13-17-28-18-14-23)19-26-15-11-22(12-16-26)25(20-7-3-1-4-8-20)21-9-5-2-6-10-21;3-1(4)2(5)6/h1-10,23H,11-19H2;(H,3,4)(H,5,6)