(E)-4-(cycloheptylamino)-2-methyl-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-(cycloheptylamino)-2-methyl-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-(cycloheptylamino)-2-methyl-4-oxo-but-2-enoate CAS Name: (E)-4-(cycloheptylamino)-2-methyl-4-oxo-2-butenoate IUPAC Name: (E)-4-(cycloheptylamino)-2-methyl-4-oxobut-2-enoate Traditional Name: (E)-4-(cycloheptylamino)-4-keto-2-methyl-but-2-enoate Formula: C12H18NO3- MolecularWeight: 224.27622

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1CCCCCC1)C(=O)[O-]

Isomeric SMILES

C/C(=C\C(=O)NC1CCCCCC1)/C(=O)[O-]

InChI

InChI=1S/C12H19NO3/c1-9(12(15)16)8-11(14)13-10-6-4-2-3-5-7-10/h8,10H,2-7H2,1H3,(H,13,14)(H,15,16)/p-1/b9-8+