methyl 4-[4-[azido(pyridin-4-yl)methyl]phenyl]butanoate

Systemtic Name: methyl 4-[4-[azido(pyridin-4-yl)methyl]phenyl]butanoate Openeye Name: methyl 4-[4-[azido(4-pyridyl)methyl]phenyl]butanoate CAS Name: 4-[4-[azido(pyridin-4-yl)methyl]phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[azido(pyridin-4-yl)methyl]phenyl]butanoate Traditional Name: 4-[4-[azido(4-pyridyl)methyl]phenyl]butyric acid methyl ester Formula: C17H18N4O2 MolecularWeight: 310.35042

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1=CC=C(C=C1)C(C2=CC=NC=C2)N=[N+]=[N-]

Isomeric SMILES

COC(=O)CCCC1=CC=C(C=C1)C(C2=CC=NC=C2)N=[N+]=[N-]

InChI

InChI=1S/C17H18N4O2/c1-23-16(22)4-2-3-13-5-7-14(8-6-13)17(20-21-18)15-9-11-19-12-10-15/h5-12,17H,2-4H2,1H3