[2-(azidomethyl)-3-(3,4-dimethylphenyl)propyl] ethanoate

Systemtic Name: [2-(azidomethyl)-3-(3,4-dimethylphenyl)propyl] ethanoate Openeye Name: [2-(azidomethyl)-3-(3,4-dimethylphenyl)propyl] acetate CAS Name: acetic acid [2-(azidomethyl)-3-(3,4-dimethylphenyl)propyl] ester IUPAC Name: [2-(azidomethyl)-3-(3,4-dimethylphenyl)propyl] acetate Traditional Name: acetic acid [2-(azidomethyl)-3-(3,4-dimethylphenyl)propyl] ester Formula: C14H19N3O2 MolecularWeight: 261.31956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC(CN=[N+]=[N-])COC(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)CC(CN=[N+]=[N-])COC(=O)C)C

InChI

InChI=1S/C14H19N3O2/c1-10-4-5-13(6-11(10)2)7-14(8-16-17-15)9-19-12(3)18/h4-6,14H,7-9H2,1-3H3