methyl (2R,3R,4S)-3-acetamido-4-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]-2-[(1S,2R)-2,3-diacetyloxy-1-methoxy-propyl]-3,4-dihydro-2H-pyran-6-carboxylate

Systemtic Name: methyl (2R,3R,4S)-3-acetamido-4-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]-2-[(1S,2R)-2,3-diacetyloxy-1-methoxy-propyl]-3,4-dihydro-2H-pyran-6-carboxylate Openeye Name: methyl (2R,3R,4S)-3-acetamido-4-[bis(tert-butoxycarbonylamino)methyleneamino]-2-[(1S,2R)-2,3-diacetoxy-1-methoxy-propyl]-3,4-dihydro-2H-pyran-6-carboxylate CAS Name: (2R,3R,4S)-3-acetamido-4-[bis[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methylideneamino]-2-[(1S,2R)-2,3-diacetyloxy-1-methoxypropyl]-3,4-dihydro-2H-pyran-6-carboxylic acid methyl ester IUPAC Name: methyl (2R,3R,4S)-3-acetamido-4-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]-2-[(1S,2R)-2,3-diacetyloxy-1-methoxypropyl]-3,4-dihydro-2H-pyran-6-carboxylate Traditional Name: (2R,3R,4S)-3-acetamido-4-[bis(tert-butoxycarbonylamino)methyleneamino]-2-[(1S,2R)-2,3-diacetoxy-1-methoxy-propyl]-3,4-dihydro-2H-pyran-6-carboxylic acid methyl ester Formula: C28H44N4O13 MolecularWeight: 644.66796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C=C(OC1C(C(COC(=O)C)OC(=O)C)OC)C(=O)OC)N=C(NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)N[C@@H]1[C@H](C=C(O[C@H]1[C@@H]([C@@H](COC(=O)C)OC(=O)C)OC)C(=O)OC)N=C(NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C28H44N4O13/c1-14(33)29-20-17(30-24(31-25(37)44-27(4,5)6)32-26(38)45-28(7,8)9)12-18(23(36)40-11)43-22(20)21(39-10)19(42-16(3)35)13-41-15(2)34/h12,17,19-22H,13H2,1-11H3,(H,29,33)(H2,30,31,32,37,38)/t17-,19+,20+,21+,22+/m0/s1