2-[8-[[(4-diazoniophenyl)-methyl-carbamoyl]amino]octanoyloxy]ethyl-trimethyl-azanium

Systemtic Name: 2-[8-[[(4-diazoniophenyl)-methyl-carbamoyl]amino]octanoyloxy]ethyl-trimethyl-azanium Openeye Name: 2-[8-[[(4-diazoniophenyl)-methyl-carbamoyl]amino]octanoyloxy]ethyl-trimethyl-ammonium CAS Name: 2-[8-[[(4-diazonio-N-methylanilino)-oxomethyl]amino]-1-oxooctoxy]ethyl-trimethylammonium IUPAC Name: 2-[8-[[(4-diazoniophenyl)-methylcarbamoyl]amino]octanoyloxy]ethyl-trimethylazanium Traditional Name: 2-[8-[[(4-diazoniophenyl)-methyl-carbamoyl]amino]octanoyloxy]ethyl-trimethyl-ammonium Formula: C21H35N5O3+2 MolecularWeight: 405.5343

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)[N+]#N)C(=O)NCCCCCCCC(=O)OCC[N+](C)(C)C

Isomeric SMILES

CN(C1=CC=C(C=C1)[N+]#N)C(=O)NCCCCCCCC(=O)OCC[N+](C)(C)C

InChI

InChI=1S/C21H34N5O3/c1-25(19-13-11-18(24-22)12-14-19)21(28)23-15-9-7-5-6-8-10-20(27)29-17-16-26(2,3)4/h11-14H,5-10,15-17H2,1-4H3/q+1/p+1