methyl (2R,3R,4S)-3-acetamido-2-(2-azanylethylcarbamoyl)-4-azido-3,4-dihydro-2H-pyran-6-carboxylate

Systemtic Name: methyl (2R,3R,4S)-3-acetamido-2-(2-azanylethylcarbamoyl)-4-azido-3,4-dihydro-2H-pyran-6-carboxylate Openeye Name: methyl (2R,3R,4S)-3-acetamido-2-(2-aminoethylcarbamoyl)-4-azido-3,4-dihydro-2H-pyran-6-carboxylate CAS Name: (2R,3R,4S)-3-acetamido-2-[(2-aminoethylamino)-oxomethyl]-4-azido-3,4-dihydro-2H-pyran-6-carboxylic acid methyl ester IUPAC Name: methyl (2R,3R,4S)-3-acetamido-2-(2-aminoethylcarbamoyl)-4-azido-3,4-dihydro-2H-pyran-6-carboxylate Traditional Name: (2R,3R,4S)-3-acetamido-2-(2-aminoethylcarbamoyl)-4-azido-3,4-dihydro-2H-pyran-6-carboxylic acid methyl ester Formula: C12H18N6O5 MolecularWeight: 326.30852

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C=C(OC1C(=O)NCCN)C(=O)OC)N=[N+]=[N-]

Isomeric SMILES

CC(=O)N[C@@H]1[C@H](C=C(O[C@H]1C(=O)NCCN)C(=O)OC)N=[N+]=[N-]

InChI

InChI=1S/C12H18N6O5/c1-6(19)16-9-7(17-18-14)5-8(12(21)22-2)23-10(9)11(20)15-4-3-13/h5,7,9-10H,3-4,13H2,1-2H3,(H,15,20)(H,16,19)/t7-,9+,10+/m0/s1