[(E)-1-(4-piperidin-1-ylphenyl)ethylideneamino] (2S)-3-(4-acetyloxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: [(E)-1-(4-piperidin-1-ylphenyl)ethylideneamino] (2S)-3-(4-acetyloxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: [(E)-1-[4-(1-piperidyl)phenyl]ethylideneamino] (2S)-3-(4-acetoxyphenyl)-2-(tert-butoxycarbonylamino)propanoate CAS Name: (2S)-3-(4-acetyloxyphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid [(E)-1-[4-(1-piperidinyl)phenyl]ethylideneamino] ester IUPAC Name: [(E)-1-(4-piperidin-1-ylphenyl)ethylideneamino] (2S)-3-(4-acetyloxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S)-3-(4-acetoxyphenyl)-2-(tert-butoxycarbonylamino)propionic acid [(E)-1-(4-piperidinophenyl)ethylideneamino] ester Formula: C29H37N3O6 MolecularWeight: 523.62058

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(=O)C(CC1=CC=C(C=C1)OC(=O)C)NC(=O)OC(C)(C)C)C2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

C/C(=N\OC(=O)[C@H](CC1=CC=C(C=C1)OC(=O)C)NC(=O)OC(C)(C)C)/C2=CC=C(C=C2)N3CCCCC3

InChI

InChI=1S/C29H37N3O6/c1-20(23-11-13-24(14-12-23)32-17-7-6-8-18-32)31-38-27(34)26(30-28(35)37-29(3,4)5)19-22-9-15-25(16-10-22)36-21(2)33/h9-16,26H,6-8,17-19H2,1-5H3,(H,30,35)/b31-20+/t26-/m0/s1