(E)-4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]carbamoylamino]-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]carbamoylamino]-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]carbamoylamino]-4-oxo-but-2-enoate CAS Name: (E)-4-[[[[(1S,2R,3S)-2,3-dimethylcyclohexyl]amino]-oxomethyl]amino]-4-oxo-2-butenoate IUPAC Name: (E)-4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]carbamoylamino]-4-oxobut-2-enoate Traditional Name: (E)-4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]carbamoylamino]-4-keto-but-2-enoate Formula: C13H19N2O4- MolecularWeight: 267.30096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)NC(=O)C=CC(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O4/c1-8-4-3-5-10(9(8)2)14-13(19)15-11(16)6-7-12(17)18/h6-10H,3-5H2,1-2H3,(H,17,18)(H2,14,15,16,19)/p-1/b7-6+/t8-,9+,10-/m0/s1