[2-(azidomethyl)-3-hexadecoxy-propoxy]methylbenzene

Systemtic Name: [2-(azidomethyl)-3-hexadecoxy-propoxy]methylbenzene Openeye Name: [2-(azidomethyl)-3-hexadecoxy-propoxy]methylbenzene CAS Name: [2-(azidomethyl)-3-hexadecoxypropoxy]methylbenzene IUPAC Name: [2-(azidomethyl)-3-hexadecoxypropoxy]methylbenzene Traditional Name: [2-(azidomethyl)-3-cetyloxy-propoxy]methylbenzene Formula: C27H47N3O2 MolecularWeight: 445.68098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(CN=[N+]=[N-])COCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(CN=[N+]=[N-])COCC1=CC=CC=C1

InChI

InChI=1S/C27H47N3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-21-31-24-27(22-29-30-28)25-32-23-26-19-16-15-17-20-26/h15-17,19-20,27H,2-14,18,21-25H2,1H3