(2S,3R,4S)-3-acetamido-4-azanyl-2-[(4-phenylmethoxypiperidin-1-yl)methyl]-3,4-dihydro-2H-pyran-6-carboxylic acid

Systemtic Name: (2S,3R,4S)-3-acetamido-4-azanyl-2-[(4-phenylmethoxypiperidin-1-yl)methyl]-3,4-dihydro-2H-pyran-6-carboxylic acid Openeye Name: (2S,3R,4S)-3-acetamido-4-amino-2-[(4-benzyloxy-1-piperidyl)methyl]-3,4-dihydro-2H-pyran-6-carboxylic acid CAS Name: (2S,3R,4S)-3-acetamido-4-amino-2-[(4-phenylmethoxy-1-piperidinyl)methyl]-3,4-dihydro-2H-pyran-6-carboxylic acid IUPAC Name: (2S,3R,4S)-3-acetamido-4-amino-2-[(4-phenylmethoxypiperidin-1-yl)methyl]-3,4-dihydro-2H-pyran-6-carboxylic acid Traditional Name: (2S,3R,4S)-3-acetamido-4-amino-2-[(4-benzoxypiperidino)methyl]-3,4-dihydro-2H-pyran-6-carboxylic acid Formula: C21H29N3O5 MolecularWeight: 403.47206

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C=C(OC1CN2CCC(CC2)OCC3=CC=CC=C3)C(=O)O)N

Isomeric SMILES

CC(=O)N[C@@H]1[C@H](C=C(O[C@H]1CN2CCC(CC2)OCC3=CC=CC=C3)C(=O)O)N

InChI

InChI=1S/C21H29N3O5/c1-14(25)23-20-17(22)11-18(21(26)27)29-19(20)12-24-9-7-16(8-10-24)28-13-15-5-3-2-4-6-15/h2-6,11,16-17,19-20H,7-10,12-13,22H2,1H3,(H,23,25)(H,26,27)/t17-,19-,20+/m0/s1