azepan-4-yl 4-oxidanylidene-3-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: azepan-4-yl 4-oxidanylidene-3-(phenylmethoxycarbonylamino)butanoate Openeye Name: azepan-4-yl 3-(benzyloxycarbonylamino)-4-oxo-butanoate CAS Name: 4-oxo-3-(phenylmethoxycarbonylamino)butanoic acid 4-azepanyl ester IUPAC Name: azepan-4-yl 4-oxo-3-(phenylmethoxycarbonylamino)butanoate Traditional Name: 3-(benzyloxycarbonylamino)-4-keto-butyric acid azepan-4-yl ester Formula: C18H24N2O5 MolecularWeight: 348.39356

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCNC1)OC(=O)CC(C=O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CC(CCNC1)OC(=O)CC(C=O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H24N2O5/c21-12-15(11-17(22)25-16-7-4-9-19-10-8-16)20-18(23)24-13-14-5-2-1-3-6-14/h1-3,5-6,12,15-16,19H,4,7-11,13H2,(H,20,23)