(2R)-2-[[(2S)-heptan-2-yl]carbamoylamino]-3-methyl-butanoate

Systemtic Name: (2R)-2-[[(2S)-heptan-2-yl]carbamoylamino]-3-methyl-butanoate Openeye Name: (2R)-3-methyl-2-[[(1S)-1-methylhexyl]carbamoylamino]butanoate CAS Name: (2R)-2-[[[[(2S)-heptan-2-yl]amino]-oxomethyl]amino]-3-methylbutanoate IUPAC Name: (2R)-2-[[(2S)-heptan-2-yl]carbamoylamino]-3-methylbutanoate Traditional Name: (2R)-3-methyl-2-[[(1S)-1-methylhexyl]carbamoylamino]butyrate Formula: C13H25N2O3- MolecularWeight: 257.3492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)NC(C(C)C)C(=O)[O-]

Isomeric SMILES

CCCCC[C@H](C)NC(=O)N[C@H](C(C)C)C(=O)[O-]

InChI

InChI=1S/C13H26N2O3/c1-5-6-7-8-10(4)14-13(18)15-11(9(2)3)12(16)17/h9-11H,5-8H2,1-4H3,(H,16,17)(H2,14,15,18)/p-1/t10-,11+/m0/s1