(3S)-3-azanyl-4-(1-azanyl-2-propyl-cyclopropyl)carbonyloxy-4-oxidanylidene-butanoic acid hydrate

Systemtic Name: (3S)-3-azanyl-4-(1-azanyl-2-propyl-cyclopropyl)carbonyloxy-4-oxidanylidene-butanoic acid hydrate Openeye Name: (3S)-3-amino-4-(1-amino-2-propyl-cyclopropanecarbonyl)oxy-4-oxo-butanoic acid hydrate CAS Name: (3S)-3-amino-4-[(1-amino-2-propylcyclopropyl)-oxomethoxy]-4-oxobutanoic acid hydrate IUPAC Name: (3S)-3-amino-4-(1-amino-2-propylcyclopropanecarbonyl)oxy-4-oxobutanoic acid hydrate Traditional Name: (3S)-3-amino-4-(1-amino-2-propyl-cyclopropanecarbonyl)oxy-4-keto-butyric acid hydrate Formula: C11H20N2O6 MolecularWeight: 276.2863

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CC1(C(=O)OC(=O)C(CC(=O)O)N)N.O

Isomeric SMILES

CCCC1CC1(C(=O)OC(=O)[C@H](CC(=O)O)N)N.O

InChI

InChI=1S/C11H18N2O5.H2O/c1-2-3-6-5-11(6,13)10(17)18-9(16)7(12)4-8(14)15;/h6-7H,2-5,12-13H2,1H3,(H,14,15);1H2/t6?,7-,11?;/m0./s1