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

Systemtic Name: (Z)-but-2-enedioic acid; ethyl 1-[2-(dimethylamino)-2-phenyl-ethyl]-4-phenyl-piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(dimethylamino)-2-phenyl-ethyl]-4-phenyl-piperidine-4-carboxylate; maleic acid CAS Name: (Z)-2-butenedioic acid; 1-[2-(dimethylamino)-2-phenylethyl]-4-phenyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: (Z)-but-2-enedioic acid; ethyl 1-[2-(dimethylamino)-2-phenylethyl]-4-phenylpiperidine-4-carboxylate Traditional Name: 1-[2-(dimethylamino)-2-phenyl-ethyl]-4-phenyl-isonipecotic acid ethyl ester; maleic acid Formula: C28H36N2O6 MolecularWeight: 496.59524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CC(C2=CC=CC=C2)N(C)C)C3=CC=CC=C3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CC(C2=CC=CC=C2)N(C)C)C3=CC=CC=C3.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C24H32N2O2.C4H4O4/c1-4-28-23(27)24(21-13-9-6-10-14-21)15-17-26(18-16-24)19-22(25(2)3)20-11-7-5-8-12-20;5-3(6)1-2-4(7)8/h5-14,22H,4,15-19H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-