3-methyl-4-[[(E)-[(3R)-3-methyl-2-oxidanylidene-cyclohexylidene]methyl]amino]benzoate

Systemtic Name: 3-methyl-4-[[(E)-[(3R)-3-methyl-2-oxidanylidene-cyclohexylidene]methyl]amino]benzoate Openeye Name: 3-methyl-4-[[(E)-[(3R)-3-methyl-2-oxo-cyclohexylidene]methyl]amino]benzoate CAS Name: 3-methyl-4-[[(E)-[(3R)-3-methyl-2-oxocyclohexylidene]methyl]amino]benzoate IUPAC Name: 3-methyl-4-[[(E)-[(3R)-3-methyl-2-oxocyclohexylidene]methyl]amino]benzoate Traditional Name: 4-[[(E)-[(3R)-2-keto-3-methyl-cyclohexylidene]methyl]amino]-3-methyl-benzoate Formula: C16H18NO3- MolecularWeight: 272.31902

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(=CNC2=C(C=C(C=C2)C(=O)[O-])C)C1=O

Isomeric SMILES

C[C@@H]1CCC/C(=C\NC2=C(C=C(C=C2)C(=O)[O-])C)/C1=O

InChI

InChI=1S/C16H19NO3/c1-10-4-3-5-13(15(10)18)9-17-14-7-6-12(16(19)20)8-11(14)2/h6-10,17H,3-5H2,1-2H3,(H,19,20)/p-1/b13-9+/t10-/m1/s1