phenethyl ethanoate; 2-(1,2,3-triazirin-1-yl)ethyl ethanoate

Systemtic Name: phenethyl ethanoate; 2-(1,2,3-triazirin-1-yl)ethyl ethanoate Openeye Name: phenethyl acetate; 2-(triazirin-1-yl)ethyl acetate CAS Name: acetic acid phenethyl ester; acetic acid 2-(1-triazirinyl)ethyl ester IUPAC Name: phenethyl acetate; 2-(triazirin-1-yl)ethyl acetate Traditional Name: acetic acid phenethyl ester; acetic acid 2-(triazirin-1-yl)ethyl ester Formula: C14H19N3O4 MolecularWeight: 293.31836

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCC1=CC=CC=C1.CC(=O)OCCN1N=N1

Isomeric SMILES

CC(=O)OCCC1=CC=CC=C1.CC(=O)OCCN1N=N1

InChI

InChI=1S/C10H12O2.C4H7N3O2/c1-9(11)12-8-7-10-5-3-2-4-6-10;1-4(8)9-3-2-7-5-6-7/h2-6H,7-8H2,1H3;2-3H2,1H3