methyl 4-[4-(1-azido-4-cyclohexyl-butyl)phenyl]butanoate

Systemtic Name: methyl 4-[4-(1-azido-4-cyclohexyl-butyl)phenyl]butanoate Openeye Name: methyl 4-[4-(1-azido-4-cyclohexyl-butyl)phenyl]butanoate CAS Name: 4-[4-(1-azido-4-cyclohexylbutyl)phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-(1-azido-4-cyclohexylbutyl)phenyl]butanoate Traditional Name: 4-[4-(1-azido-4-cyclohexyl-butyl)phenyl]butyric acid methyl ester Formula: C21H31N3O2 MolecularWeight: 357.48974

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1=CC=C(C=C1)C(CCCC2CCCCC2)N=[N+]=[N-]

Isomeric SMILES

COC(=O)CCCC1=CC=C(C=C1)C(CCCC2CCCCC2)N=[N+]=[N-]

InChI

InChI=1S/C21H31N3O2/c1-26-21(25)12-6-10-18-13-15-19(16-14-18)20(23-24-22)11-5-9-17-7-3-2-4-8-17/h13-17,20H,2-12H2,1H3