methyl 2-[[2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl]amino]benzoate

Systemtic Name: methyl 2-[[2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl]amino]benzoate Openeye Name: methyl 2-[[2-[(1-cyanocyclohexyl)amino]-2-oxo-ethyl]amino]benzoate CAS Name: 2-[[2-[(1-cyanocyclohexyl)amino]-2-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[(1-cyanocyclohexyl)amino]-2-oxoethyl]amino]benzoate Traditional Name: 2-[[2-[(1-cyanocyclohexyl)amino]-2-keto-ethyl]amino]benzoic acid methyl ester Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NCC(=O)NC2(CCCCC2)C#N

Isomeric SMILES

COC(=O)C1=CC=CC=C1NCC(=O)NC2(CCCCC2)C#N

InChI

InChI=1S/C17H21N3O3/c1-23-16(22)13-7-3-4-8-14(13)19-11-15(21)20-17(12-18)9-5-2-6-10-17/h3-4,7-8,19H,2,5-6,9-11H2,1H3,(H,20,21)