(Z)-but-2-enedioic acid; ethyl 1-[2-(diethylamino)-2-phenyl-ethyl]-4-phenyl-piperidine-4-carboxylate

Systemtic Name: (Z)-but-2-enedioic acid; ethyl 1-[2-(diethylamino)-2-phenyl-ethyl]-4-phenyl-piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(diethylamino)-2-phenyl-ethyl]-4-phenyl-piperidine-4-carboxylate; maleic acid CAS Name: (Z)-2-butenedioic acid; 1-[2-(diethylamino)-2-phenylethyl]-4-phenyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: (Z)-but-2-enedioic acid; ethyl 1-[2-(diethylamino)-2-phenylethyl]-4-phenylpiperidine-4-carboxylate Traditional Name: 1-[2-(diethylamino)-2-phenyl-ethyl]-4-phenyl-isonipecotic acid ethyl ester; maleic acid Formula: C30H40N2O6 MolecularWeight: 524.6484

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CN1CCC(CC1)(C2=CC=CC=C2)C(=O)OCC)C3=CC=CC=C3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCN(CC)C(CN1CCC(CC1)(C2=CC=CC=C2)C(=O)OCC)C3=CC=CC=C3.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C26H36N2O2.C4H4O4/c1-4-28(5-2)24(22-13-9-7-10-14-22)21-27-19-17-26(18-20-27,25(29)30-6-3)23-15-11-8-12-16-23;5-3(6)1-2-4(7)8/h7-16,24H,4-6,17-21H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-