[5-acetamido-3,4-diacetyloxy-6-(4-azanylbutanoylamino)oxan-2-yl]methyl ethanoate

Systemtic Name: [5-acetamido-3,4-diacetyloxy-6-(4-azanylbutanoylamino)oxan-2-yl]methyl ethanoate Openeye Name: [5-acetamido-3,4-diacetoxy-6-(4-aminobutanoylamino)tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [5-acetamido-3,4-diacetyloxy-6-[(4-amino-1-oxobutyl)amino]-2-oxanyl]methyl ester IUPAC Name: [5-acetamido-3,4-diacetyloxy-6-(4-aminobutanoylamino)oxan-2-yl]methyl acetate Traditional Name: acetic acid [5-acetamido-3,4-diacetoxy-6-(4-aminobutanoylamino)tetrahydropyran-2-yl]methyl ester Formula: C18H29N3O9 MolecularWeight: 431.43756

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C(C(OC1NC(=O)CCCN)COC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)NC1C(C(C(OC1NC(=O)CCCN)COC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C18H29N3O9/c1-9(22)20-15-17(29-12(4)25)16(28-11(3)24)13(8-27-10(2)23)30-18(15)21-14(26)6-5-7-19/h13,15-18H,5-8,19H2,1-4H3,(H,20,22)(H,21,26)