[2-(cycloheptylamino)-2-oxidanylidene-ethyl] 3-cyanobenzoate

Systemtic Name: [2-(cycloheptylamino)-2-oxidanylidene-ethyl] 3-cyanobenzoate Openeye Name: [2-(cycloheptylamino)-2-oxo-ethyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [2-(cycloheptylamino)-2-oxoethyl] ester IUPAC Name: [2-(cycloheptylamino)-2-oxoethyl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [2-(cycloheptylamino)-2-keto-ethyl] ester Formula: C17H20N2O3 MolecularWeight: 300.3523

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)COC(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

C1CCCC(CC1)NC(=O)COC(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C17H20N2O3/c18-11-13-6-5-7-14(10-13)17(21)22-12-16(20)19-15-8-3-1-2-4-9-15/h5-7,10,15H,1-4,8-9,12H2,(H,19,20)