methyl (3R)-4-(2,2-diphenylethanoyl)-3-[[(3S)-3-oxidanylpiperidin-1-yl]methyl]piperazine-1-carboxylate

Systemtic Name: methyl (3R)-4-(2,2-diphenylethanoyl)-3-[[(3S)-3-oxidanylpiperidin-1-yl]methyl]piperazine-1-carboxylate Openeye Name: methyl (3R)-4-(2,2-diphenylacetyl)-3-[[(3S)-3-hydroxy-1-piperidyl]methyl]piperazine-1-carboxylate CAS Name: (3R)-3-[[(3S)-3-hydroxy-1-piperidinyl]methyl]-4-(1-oxo-2,2-diphenylethyl)-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl (3R)-4-(2,2-diphenylacetyl)-3-[[(3S)-3-hydroxypiperidin-1-yl]methyl]piperazine-1-carboxylate Traditional Name: (3R)-4-(2,2-diphenylacetyl)-3-[[(3S)-3-hydroxypiperidino]methyl]piperazine-1-carboxylic acid methyl ester Formula: C26H33N3O4 MolecularWeight: 451.55792

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCN(C(C1)CN2CCCC(C2)O)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)N1CCN([C@@H](C1)CN2CCC[C@@H](C2)O)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H33N3O4/c1-33-26(32)28-15-16-29(22(18-28)17-27-14-8-13-23(30)19-27)25(31)24(20-9-4-2-5-10-20)21-11-6-3-7-12-21/h2-7,9-12,22-24,30H,8,13-19H2,1H3/t22-,23+/m1/s1