[2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-oxidanyl-2,2-diphenyl-ethanoate

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-oxidanyl-2,2-diphenyl-ethanoate Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl] 2-hydroxy-2,2-diphenyl-acetate CAS Name: 2-hydroxy-2,2-diphenylacetic acid [2-(1-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl] 2-hydroxy-2,2-diphenylacetate Traditional Name: 2-hydroxy-2,2-diphenyl-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)C(C2=CC=CC=C2)(C3=CC=CC=C3)O

Isomeric SMILES

C1CCCN(CC1)C(=O)COC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O

InChI

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