[3-(4-chlorophenyl)-2-methyl-propyl] 3-azidobenzoate

Systemtic Name: [3-(4-chlorophenyl)-2-methyl-propyl] 3-azidobenzoate Openeye Name: [3-(4-chlorophenyl)-2-methyl-propyl] 3-azidobenzoate CAS Name: 3-azidobenzoic acid [3-(4-chlorophenyl)-2-methylpropyl] ester IUPAC Name: [3-(4-chlorophenyl)-2-methylpropyl] 3-azidobenzoate Traditional Name: 3-azidobenzoic acid [3-(4-chlorophenyl)-2-methyl-propyl] ester Formula: C17H16ClN3O2 MolecularWeight: 329.78084

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)Cl)COC(=O)C2=CC(=CC=C2)N=[N+]=[N-]

Isomeric SMILES

CC(CC1=CC=C(C=C1)Cl)COC(=O)C2=CC(=CC=C2)N=[N+]=[N-]

InChI

InChI=1S/C17H16ClN3O2/c1-12(9-13-5-7-15(18)8-6-13)11-23-17(22)14-3-2-4-16(10-14)20-21-19/h2-8,10,12H,9,11H2,1H3