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

Systemtic Name: methyl 4-[4-(1-azidononyl)phenyl]butanoate Openeye Name: methyl 4-[4-(1-azidononyl)phenyl]butanoate CAS Name: 4-[4-(1-azidononyl)phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-(1-azidononyl)phenyl]butanoate Traditional Name: 4-[4-(1-azidononyl)phenyl]butyric acid methyl ester Formula: C20H31N3O2 MolecularWeight: 345.47904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H31N3O2/c1-3-4-5-6-7-8-11-19(22-23-21)18-15-13-17(14-16-18)10-9-12-20(24)25-2/h13-16,19H,3-12H2,1-2H3