O1-ethyl O4-[(2R)-1-oxidanylidene-1-[(4-piperidin-1-ylphenyl)amino]propan-2-yl] (E)-but-2-enedioate

Systemtic Name: O1-ethyl O4-[(2R)-1-oxidanylidene-1-[(4-piperidin-1-ylphenyl)amino]propan-2-yl] (E)-but-2-enedioate Openeye Name: O1-ethyl O4-[(1R)-1-methyl-2-oxo-2-[4-(1-piperidyl)anilino]ethyl] (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-ethyl ester O4-[(2R)-1-oxo-1-[4-(1-piperidinyl)anilino]propan-2-yl] ester IUPAC Name: 1-O-ethyl 4-O-[(2R)-1-oxo-1-(4-piperidin-1-ylanilino)propan-2-yl] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O1-ethyl ester O4-[(1R)-2-keto-1-methyl-2-(4-piperidinoanilino)ethyl] ester Formula: C20H26N2O5 MolecularWeight: 374.43084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OC(C)C(=O)NC1=CC=C(C=C1)N2CCCCC2

Isomeric SMILES

CCOC(=O)/C=C/C(=O)O[C@H](C)C(=O)NC1=CC=C(C=C1)N2CCCCC2

InChI

InChI=1S/C20H26N2O5/c1-3-26-18(23)11-12-19(24)27-15(2)20(25)21-16-7-9-17(10-8-16)22-13-5-4-6-14-22/h7-12,15H,3-6,13-14H2,1-2H3,(H,21,25)/b12-11+/t15-/m1/s1