ethanedioic acid; 2-piperidin-1-ylethyl 2,2-bis(4-methylphenyl)cyclopropane-1-carboxylate

Systemtic Name: ethanedioic acid; 2-piperidin-1-ylethyl 2,2-bis(4-methylphenyl)cyclopropane-1-carboxylate Openeye Name: oxalic acid; 2-(1-piperidyl)ethyl 2,2-bis(p-tolyl)cyclopropanecarboxylate CAS Name: 2,2-bis(4-methylphenyl)-1-cyclopropanecarboxylic acid 2-(1-piperidinyl)ethyl ester; oxalic acid IUPAC Name: oxalic acid; 2-piperidin-1-ylethyl 2,2-bis(4-methylphenyl)cyclopropane-1-carboxylate Traditional Name: 2,2-bis(p-tolyl)cyclopropanecarboxylic acid 2-piperidinoethyl ester; oxalic acid Formula: C27H33NO6 MolecularWeight: 467.55402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(CC2C(=O)OCCN3CCCCC3)C4=CC=C(C=C4)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2(CC2C(=O)OCCN3CCCCC3)C4=CC=C(C=C4)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H31NO2.C2H2O4/c1-19-6-10-21(11-7-19)25(22-12-8-20(2)9-13-22)18-23(25)24(27)28-17-16-26-14-4-3-5-15-26;3-1(4)2(5)6/h6-13,23H,3-5,14-18H2,1-2H3;(H,3,4)(H,5,6)