(2R,3R,4S)-3-acetamido-4-azanyl-2-(phenethylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylic acid

Systemtic Name: (2R,3R,4S)-3-acetamido-4-azanyl-2-(phenethylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Openeye Name: (2R,3R,4S)-3-acetamido-4-amino-2-(phenethylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylic acid CAS Name: (2R,3R,4S)-3-acetamido-4-amino-2-[oxo-(phenethylamino)methyl]-3,4-dihydro-2H-pyran-6-carboxylic acid IUPAC Name: (2R,3R,4S)-3-acetamido-4-amino-2-(phenethylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Traditional Name: (2R,3R,4S)-3-acetamido-4-amino-2-(phenethylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Formula: C17H21N3O5 MolecularWeight: 347.36574

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C=C(OC1C(=O)NCCC2=CC=CC=C2)C(=O)O)N

Isomeric SMILES

CC(=O)N[C@@H]1[C@H](C=C(O[C@H]1C(=O)NCCC2=CC=CC=C2)C(=O)O)N

InChI

InChI=1S/C17H21N3O5/c1-10(21)20-14-12(18)9-13(17(23)24)25-15(14)16(22)19-8-7-11-5-3-2-4-6-11/h2-6,9,12,14-15H,7-8,18H2,1H3,(H,19,22)(H,20,21)(H,23,24)/t12-,14+,15+/m0/s1