(1R,6S)-6-(2-acetamidoethylcarbamoyl)cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6S)-6-(2-acetamidoethylcarbamoyl)cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6S)-6-(2-acetamidoethylcarbamoyl)cyclohex-3-ene-1-carboxylate CAS Name: (1R,6S)-6-[(2-acetamidoethylamino)-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6S)-6-(2-acetamidoethylcarbamoyl)cyclohex-3-ene-1-carboxylate Traditional Name: (1R,6S)-6-(2-acetamidoethylcarbamoyl)cyclohex-3-ene-1-carboxylate Formula: C12H17N2O4- MolecularWeight: 253.27438

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC(=O)C1CC=CCC1C(=O)[O-]

Isomeric SMILES

CC(=O)NCCNC(=O)[C@H]1CC=CC[C@H]1C(=O)[O-]

InChI

InChI=1S/C12H18N2O4/c1-8(15)13-6-7-14-11(16)9-4-2-3-5-10(9)12(17)18/h2-3,9-10H,4-7H2,1H3,(H,13,15)(H,14,16)(H,17,18)/p-1/t9-,10+/m0/s1