4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]carbamoylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]carbamoylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]carbamoylamino]-4-oxo-butanoate CAS Name: 4-[[[[(1S,2R,3S)-2,3-dimethylcyclohexyl]amino]-oxomethyl]amino]-4-oxobutanoate IUPAC Name: 4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]carbamoylamino]-4-oxobutanoate Traditional Name: 4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]carbamoylamino]-4-keto-butyrate Formula: C13H21N2O4- MolecularWeight: 269.31684

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)NC(=O)CCC(=O)[O-]

Isomeric SMILES

C[C@H]1CCC[C@@H]([C@@H]1C)NC(=O)NC(=O)CCC(=O)[O-]

InChI

InChI=1S/C13H22N2O4/c1-8-4-3-5-10(9(8)2)14-13(19)15-11(16)6-7-12(17)18/h8-10H,3-7H2,1-2H3,(H,17,18)(H2,14,15,16,19)/p-1/t8-,9+,10-/m0/s1