4-[(1-ethynylcyclohexyl)amino]-4-oxidanylidene-but-2-enoate

Systemtic Name: 4-[(1-ethynylcyclohexyl)amino]-4-oxidanylidene-but-2-enoate Openeye Name: 4-[(1-ethynylcyclohexyl)amino]-4-oxo-but-2-enoate CAS Name: 4-[(1-ethynylcyclohexyl)amino]-4-oxo-2-butenoate IUPAC Name: 4-[(1-ethynylcyclohexyl)amino]-4-oxobut-2-enoate Traditional Name: 4-[(1-ethynylcyclohexyl)amino]-4-keto-but-2-enoate Formula: C12H14NO3- MolecularWeight: 220.24446

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1(CCCCC1)NC(=O)C=CC(=O)[O-]

Isomeric SMILES

C#CC1(CCCCC1)NC(=O)C=CC(=O)[O-]

InChI

InChI=1S/C12H15NO3/c1-2-12(8-4-3-5-9-12)13-10(14)6-7-11(15)16/h1,6-7H,3-5,8-9H2,(H,13,14)(H,15,16)/p-1