methyl 3,5-bis[[3-azido-2,2-bis(azidomethyl)propoxy]methyl]benzoate

Systemtic Name: methyl 3,5-bis[[3-azido-2,2-bis(azidomethyl)propoxy]methyl]benzoate Openeye Name: methyl 3,5-bis[[3-azido-2,2-bis(azidomethyl)propoxy]methyl]benzoate CAS Name: 3,5-bis[[3-azido-2,2-bis(azidomethyl)propoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 3,5-bis[[3-azido-2,2-bis(azidomethyl)propoxy]methyl]benzoate Traditional Name: 3,5-bis[[3-azido-2,2-bis(azidomethyl)propoxy]methyl]benzoic acid methyl ester Formula: C20H26N18O4 MolecularWeight: 582.53864

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)COCC(CN=[N+]=[N-])(CN=[N+]=[N-])CN=[N+]=[N-])COCC(CN=[N+]=[N-])(CN=[N+]=[N-])CN=[N+]=[N-]

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)COCC(CN=[N+]=[N-])(CN=[N+]=[N-])CN=[N+]=[N-])COCC(CN=[N+]=[N-])(CN=[N+]=[N-])CN=[N+]=[N-]

InChI

InChI=1S/C20H26N18O4/c1-40-18(39)17-3-15(5-41-13-19(7-27-33-21,8-28-34-22)9-29-35-23)2-16(4-17)6-42-14-20(10-30-36-24,11-31-37-25)12-32-38-26/h2-4H,5-14H2,1H3