methyl 4-[4-(1-azidopentyl)phenyl]butanoate

Systemtic Name: methyl 4-[4-(1-azidopentyl)phenyl]butanoate Openeye Name: methyl 4-[4-(1-azidopentyl)phenyl]butanoate CAS Name: 4-[4-(1-azidopentyl)phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-(1-azidopentyl)phenyl]butanoate Traditional Name: 4-[4-(1-azidopentyl)phenyl]butyric acid methyl ester Formula: C16H23N3O2 MolecularWeight: 289.37272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O2/c1-3-4-7-15(18-19-17)14-11-9-13(10-12-14)6-5-8-16(20)21-2/h9-12,15H,3-8H2,1-2H3