[2-(cycloheptylamino)-2-oxidanylidene-ethyl] 4-cyanobenzoate

Systemtic Name: [2-(cycloheptylamino)-2-oxidanylidene-ethyl] 4-cyanobenzoate Openeye Name: [2-(cycloheptylamino)-2-oxo-ethyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [2-(cycloheptylamino)-2-oxoethyl] ester IUPAC Name: [2-(cycloheptylamino)-2-oxoethyl] 4-cyanobenzoate Traditional Name: 4-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=C(C=C2)C#N

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O3/c18-11-13-7-9-14(10-8-13)17(21)22-12-16(20)19-15-5-3-1-2-4-6-15/h7-10,15H,1-6,12H2,(H,19,20)