methyl 2-[4-[[5-(azidomethyl)-2-butyl-4-chloranyl-imidazol-1-yl]methyl]phenyl]carbonylbenzoate

Systemtic Name: methyl 2-[4-[[5-(azidomethyl)-2-butyl-4-chloranyl-imidazol-1-yl]methyl]phenyl]carbonylbenzoate Openeye Name: methyl 2-[4-[[5-(azidomethyl)-2-butyl-4-chloro-imidazol-1-yl]methyl]benzoyl]benzoate CAS Name: 2-[[4-[[5-(azidomethyl)-2-butyl-4-chloro-1-imidazolyl]methyl]phenyl]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[[5-(azidomethyl)-2-butyl-4-chloroimidazol-1-yl]methyl]benzoyl]benzoate Traditional Name: 2-[4-[[5-(azidomethyl)-2-butyl-4-chloro-imidazol-1-yl]methyl]benzoyl]benzoic acid methyl ester Formula: C24H24ClN5O3 MolecularWeight: 465.93206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C(=O)C3=CC=CC=C3C(=O)OC)CN=[N+]=[N-])Cl

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C(=O)C3=CC=CC=C3C(=O)OC)CN=[N+]=[N-])Cl

InChI

InChI=1S/C24H24ClN5O3/c1-3-4-9-21-28-23(25)20(14-27-29-26)30(21)15-16-10-12-17(13-11-16)22(31)18-7-5-6-8-19(18)24(32)33-2/h5-8,10-13H,3-4,9,14-15H2,1-2H3