[(4Z,6E)-2-oxidanylidene-1-azacyclotrideca-4,6-dien-7-yl] ethanoate

Systemtic Name: [(4Z,6E)-2-oxidanylidene-1-azacyclotrideca-4,6-dien-7-yl] ethanoate Openeye Name: [(4Z,6E)-2-oxo-1-azacyclotrideca-4,6-dien-7-yl] acetate CAS Name: acetic acid [(4Z,6E)-2-oxo-1-azacyclotrideca-4,6-dien-7-yl] ester IUPAC Name: [(4Z,6E)-2-oxo-1-azacyclotrideca-4,6-dien-7-yl] acetate Traditional Name: acetic acid [(4Z,6E)-2-keto-1-azacyclotrideca-4,6-dien-7-yl] ester Formula: C14H21NO3 MolecularWeight: 251.32144

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CCC(=O)NCCCCCC1

Isomeric SMILES

CC(=O)O/C/1=C/C=C\CC(=O)NCCCCCC1

InChI

InChI=1S/C14H21NO3/c1-12(16)18-13-8-4-2-3-7-11-15-14(17)10-6-5-9-13/h5-6,9H,2-4,7-8,10-11H2,1H3,(H,15,17)/b6-5-,13-9+