methyl 4-[4-[azido-(4-methylphenyl)methyl]phenyl]butanoate

Systemtic Name: methyl 4-[4-[azido-(4-methylphenyl)methyl]phenyl]butanoate Openeye Name: methyl 4-[4-[azido(p-tolyl)methyl]phenyl]butanoate CAS Name: 4-[4-[azido-(4-methylphenyl)methyl]phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[azido-(4-methylphenyl)methyl]phenyl]butanoate Traditional Name: 4-[4-[azido(p-tolyl)methyl]phenyl]butyric acid methyl ester Formula: C19H21N3O2 MolecularWeight: 323.38894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=C(C=C2)CCCC(=O)OC)N=[N+]=[N-]

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=C(C=C2)CCCC(=O)OC)N=[N+]=[N-]

InChI

InChI=1S/C19H21N3O2/c1-14-6-10-16(11-7-14)19(21-22-20)17-12-8-15(9-13-17)4-3-5-18(23)24-2/h6-13,19H,3-5H2,1-2H3