ethyl 3-oxidanyl-2-oxidanylidene-3-phenyl-azepane-1-carboxylate

Systemtic Name: ethyl 3-oxidanyl-2-oxidanylidene-3-phenyl-azepane-1-carboxylate Openeye Name: ethyl 3-hydroxy-2-oxo-3-phenyl-azepane-1-carboxylate CAS Name: 3-hydroxy-2-oxo-3-phenyl-1-azepanecarboxylic acid ethyl ester IUPAC Name: ethyl 3-hydroxy-2-oxo-3-phenylazepane-1-carboxylate Traditional Name: 3-hydroxy-2-keto-3-phenyl-azepane-1-carboxylic acid ethyl ester Formula: C15H19NO4 MolecularWeight: 277.31566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCCCC(C1=O)(C2=CC=CC=C2)O

Isomeric SMILES

CCOC(=O)N1CCCCC(C1=O)(C2=CC=CC=C2)O

InChI

InChI=1S/C15H19NO4/c1-2-20-14(18)16-11-7-6-10-15(19,13(16)17)12-8-4-3-5-9-12/h3-5,8-9,19H,2,6-7,10-11H2,1H3