[[(3R,4R,5S,6S)-3-(butanoylamino)-6-methanoyl-4,5-bis(oxidanyl)oxan-2-yl]amino] N-phenylcarbamate

Systemtic Name: [[(3R,4R,5S,6S)-3-(butanoylamino)-6-methanoyl-4,5-bis(oxidanyl)oxan-2-yl]amino] N-phenylcarbamate Openeye Name: [[(3R,4R,5S,6S)-3-(butanoylamino)-6-formyl-4,5-dihydroxy-tetrahydropyran-2-yl]amino] N-phenylcarbamate CAS Name: N-phenylcarbamic acid [[(3R,4R,5S,6S)-6-formyl-4,5-dihydroxy-3-(1-oxobutylamino)-2-oxanyl]amino] ester IUPAC Name: [[(3R,4R,5S,6S)-3-(butanoylamino)-6-formyl-4,5-dihydroxyoxan-2-yl]amino] N-phenylcarbamate Traditional Name: N-phenylcarbamic acid [[(3R,4R,5S,6S)-3-butyramido-6-formyl-4,5-dihydroxy-tetrahydropyran-2-yl]amino] ester Formula: C17H23N3O7 MolecularWeight: 381.38042

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1C(C(C(OC1NOC(=O)NC2=CC=CC=C2)C=O)O)O

Isomeric SMILES

CCCC(=O)N[C@@H]1[C@H]([C@@H]([C@H](OC1NOC(=O)NC2=CC=CC=C2)C=O)O)O

InChI

InChI=1S/C17H23N3O7/c1-2-6-12(22)19-13-15(24)14(23)11(9-21)26-16(13)20-27-17(25)18-10-7-4-3-5-8-10/h3-5,7-9,11,13-16,20,23-24H,2,6H2,1H3,(H,18,25)(H,19,22)/t11-,13-,14-,15-,16?/m1/s1