butyl 2-(3-azido-2-oxidanylidene-7-phenyl-azepan-1-yl)ethanoate

Systemtic Name: butyl 2-(3-azido-2-oxidanylidene-7-phenyl-azepan-1-yl)ethanoate Openeye Name: butyl 2-(3-azido-2-oxo-7-phenyl-azepan-1-yl)acetate CAS Name: 2-(3-azido-2-oxo-7-phenyl-1-azepanyl)acetic acid butyl ester IUPAC Name: butyl 2-(3-azido-2-oxo-7-phenylazepan-1-yl)acetate Traditional Name: 2-(3-azido-2-keto-7-phenyl-azepan-1-yl)acetic acid butyl ester Formula: C18H24N4O3 MolecularWeight: 344.40816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CN1C(CCCC(C1=O)N=[N+]=[N-])C2=CC=CC=C2

Isomeric SMILES

CCCCOC(=O)CN1C(CCCC(C1=O)N=[N+]=[N-])C2=CC=CC=C2

InChI

InChI=1S/C18H24N4O3/c1-2-3-12-25-17(23)13-22-16(14-8-5-4-6-9-14)11-7-10-15(18(22)24)20-21-19/h4-6,8-9,15-16H,2-3,7,10-13H2,1H3