(phenylmethyl) (3S)-3-formamido-2-oxidanylidene-azepane-1-carboxylate

Systemtic Name: (phenylmethyl) (3S)-3-formamido-2-oxidanylidene-azepane-1-carboxylate Openeye Name: benzyl (3S)-3-formamido-2-oxo-azepane-1-carboxylate CAS Name: (3S)-3-formamido-2-oxo-1-azepanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (3S)-3-formamido-2-oxoazepane-1-carboxylate Traditional Name: (3S)-3-formamido-2-keto-azepane-1-carboxylic acid benzyl ester Formula: C15H18N2O4 MolecularWeight: 290.31442

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C(C1)NC=O)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CCN(C(=O)[C@H](C1)NC=O)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C15H18N2O4/c18-11-16-13-8-4-5-9-17(14(13)19)15(20)21-10-12-6-2-1-3-7-12/h1-3,6-7,11,13H,4-5,8-10H2,(H,16,18)/t13-/m0/s1