[1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 2-(2-phenoxyethanoylamino)ethanoate

Systemtic Name: [1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 2-(2-phenoxyethanoylamino)ethanoate Openeye Name: [2-(azepan-1-yl)-1-methyl-2-oxo-ethyl] 2-[(2-phenoxyacetyl)amino]acetate CAS Name: 2-[(1-oxo-2-phenoxyethyl)amino]acetic acid [1-(1-azepanyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(azepan-1-yl)-1-oxopropan-2-yl] 2-[(2-phenoxyacetyl)amino]acetate Traditional Name: 2-[(2-phenoxyacetyl)amino]acetic acid [2-(azepan-1-yl)-2-keto-1-methyl-ethyl] ester Formula: C19H26N2O5 MolecularWeight: 362.42014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)OC(=O)CNC(=O)COC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)N1CCCCCC1)OC(=O)CNC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C19H26N2O5/c1-15(19(24)21-11-7-2-3-8-12-21)26-18(23)13-20-17(22)14-25-16-9-5-4-6-10-16/h4-6,9-10,15H,2-3,7-8,11-14H2,1H3,(H,20,22)