(2R,3S)-2-[2-(2-azaniumylethanoylamino)ethanoylamino]-3-methyl-pentanoate

Systemtic Name: (2R,3S)-2-[2-(2-azaniumylethanoylamino)ethanoylamino]-3-methyl-pentanoate Openeye Name: (2R,3S)-2-[[2-[(2-azaniumylacetyl)amino]acetyl]amino]-3-methyl-pentanoate CAS Name: (2R,3S)-2-[[2-[(2-ammonio-1-oxoethyl)amino]-1-oxoethyl]amino]-3-methylpentanoate IUPAC Name: (2R,3S)-2-[[2-[(2-azaniumylacetyl)amino]acetyl]amino]-3-methylpentanoate Traditional Name: (2R,3S)-2-[[2-[(2-ammonioacetyl)amino]acetyl]amino]-3-methyl-valerate Formula: C10H19N3O4 MolecularWeight: 245.27556

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)CNC(=O)C[NH3+]

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)[O-])NC(=O)CNC(=O)C[NH3+]

InChI

InChI=1S/C10H19N3O4/c1-3-6(2)9(10(16)17)13-8(15)5-12-7(14)4-11/h6,9H,3-5,11H2,1-2H3,(H,12,14)(H,13,15)(H,16,17)/t6-,9+/m0/s1