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

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-(2-phenylphenoxy)ethanoate Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl] 2-(2-phenylphenoxy)acetate CAS Name: 2-(2-phenylphenoxy)acetic acid [2-(1-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl] 2-(2-phenylphenoxy)acetate Traditional Name: 2-(2-phenylphenoxy)acetic acid [2-(azepan-1-yl)-2-keto-ethyl] ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)COC(=O)COC2=CC=CC=C2C3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)C(=O)COC(=O)COC2=CC=CC=C2C3=CC=CC=C3

InChI

InChI=1S/C22H25NO4/c24-21(23-14-8-1-2-9-15-23)16-27-22(25)17-26-20-13-7-6-12-19(20)18-10-4-3-5-11-18/h3-7,10-13H,1-2,8-9,14-17H2