[1-[(1-cyanocyclohexyl)amino]-1-oxidanylidene-propan-2-yl] naphthalene-1-carboxylate

Systemtic Name: [1-[(1-cyanocyclohexyl)amino]-1-oxidanylidene-propan-2-yl] naphthalene-1-carboxylate Openeye Name: [2-[(1-cyanocyclohexyl)amino]-1-methyl-2-oxo-ethyl] naphthalene-1-carboxylate CAS Name: 1-naphthalenecarboxylic acid [1-[(1-cyanocyclohexyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(1-cyanocyclohexyl)amino]-1-oxopropan-2-yl] naphthalene-1-carboxylate Traditional Name: naphthalene-1-carboxylic acid [2-[(1-cyanocyclohexyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1(CCCCC1)C#N)OC(=O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(C(=O)NC1(CCCCC1)C#N)OC(=O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H22N2O3/c1-15(19(24)23-21(14-22)12-5-2-6-13-21)26-20(25)18-11-7-9-16-8-3-4-10-17(16)18/h3-4,7-11,15H,2,5-6,12-13H2,1H3,(H,23,24)