methyl 5-[4-(1-azidohexyl)phenyl]pentanoate

Systemtic Name: methyl 5-[4-(1-azidohexyl)phenyl]pentanoate Openeye Name: methyl 5-[4-(1-azidohexyl)phenyl]pentanoate CAS Name: 5-[4-(1-azidohexyl)phenyl]pentanoic acid methyl ester IUPAC Name: methyl 5-[4-(1-azidohexyl)phenyl]pentanoate Traditional Name: 5-[4-(1-azidohexyl)phenyl]valeric acid methyl ester Formula: C18H27N3O2 MolecularWeight: 317.42588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O2/c1-3-4-5-9-17(20-21-19)16-13-11-15(12-14-16)8-6-7-10-18(22)23-2/h11-14,17H,3-10H2,1-2H3