[2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-(2-cyanophenoxy)ethanoate

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-(2-cyanophenoxy)ethanoate Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl] 2-(2-cyanophenoxy)acetate CAS Name: 2-(2-cyanophenoxy)acetic acid [2-(1-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl] 2-(2-cyanophenoxy)acetate Traditional Name: 2-(2-cyanophenoxy)acetic acid [2-(azepan-1-yl)-2-keto-ethyl] ester Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)COC(=O)COC2=CC=CC=C2C#N

Isomeric SMILES

C1CCCN(CC1)C(=O)COC(=O)COC2=CC=CC=C2C#N

InChI

InChI=1S/C17H20N2O4/c18-11-14-7-3-4-8-15(14)22-13-17(21)23-12-16(20)19-9-5-1-2-6-10-19/h3-4,7-8H,1-2,5-6,9-10,12-13H2