(phenylmethyl) 2-[4-(5-oxidanylideneoxolan-2-yl)carbonyl-1,4-diazepan-1-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[4-(5-oxidanylideneoxolan-2-yl)carbonyl-1,4-diazepan-1-yl]ethanoate Openeye Name: benzyl 2-[4-(5-oxotetrahydrofuran-2-carbonyl)-1,4-diazepan-1-yl]acetate CAS Name: 2-[4-[oxo-(5-oxo-2-oxolanyl)methyl]-1,4-diazepan-1-yl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[4-(5-oxooxolane-2-carbonyl)-1,4-diazepan-1-yl]acetate Traditional Name: 2-[4-(5-ketotetrahydrofuran-2-carbonyl)-1,4-diazepan-1-yl]acetic acid benzyl ester Formula: C19H24N2O5 MolecularWeight: 360.40426

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2CCC(=O)O2)CC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2CCC(=O)O2)CC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C19H24N2O5/c22-17-8-7-16(26-17)19(24)21-10-4-9-20(11-12-21)13-18(23)25-14-15-5-2-1-3-6-15/h1-3,5-6,16H,4,7-14H2