[2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-benzamidoethanoate

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-benzamidoethanoate Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl] 2-benzamidoacetate CAS Name: 2-benzamidoacetic acid [2-(1-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl] 2-benzamidoacetate Traditional Name: 2-benzamidoacetic acid [2-(azepan-1-yl)-2-keto-ethyl] ester Formula: C17H22N2O4 MolecularWeight: 318.36758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2O4/c20-15(19-10-6-1-2-7-11-19)13-23-16(21)12-18-17(22)14-8-4-3-5-9-14/h3-5,8-9H,1-2,6-7,10-13H2,(H,18,22)