[2-(azepan-1-yl)-2-oxidanylidene-ethyl] 3-(2-phenylethanoylamino)propanoate

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] 3-(2-phenylethanoylamino)propanoate Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl] 3-[(2-phenylacetyl)amino]propanoate CAS Name: 3-[(1-oxo-2-phenylethyl)amino]propanoic acid [2-(1-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl] 3-[(2-phenylacetyl)amino]propanoate Traditional Name: 3-[(2-phenylacetyl)amino]propionic acid [2-(azepan-1-yl)-2-keto-ethyl] ester Formula: C19H26N2O4 MolecularWeight: 346.42074

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)COC(=O)CCNC(=O)CC2=CC=CC=C2

Isomeric SMILES

C1CCCN(CC1)C(=O)COC(=O)CCNC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C19H26N2O4/c22-17(14-16-8-4-3-5-9-16)20-11-10-19(24)25-15-18(23)21-12-6-1-2-7-13-21/h3-5,8-9H,1-2,6-7,10-15H2,(H,20,22)