trimethyl-[2-methyl-4-phenyldiazenyl-5-[2,3,4,5-tetrakis(oxidanyl)heptylamino]phenyl]azanium

Systemtic Name: trimethyl-[2-methyl-4-phenyldiazenyl-5-[2,3,4,5-tetrakis(oxidanyl)heptylamino]phenyl]azanium Openeye Name: trimethyl-[2-methyl-4-phenylazo-5-(2,3,4,5-tetrahydroxyheptylamino)phenyl]ammonium CAS Name: trimethyl-[2-methyl-4-phenyldiazenyl-5-(2,3,4,5-tetrahydroxyheptylamino)phenyl]ammonium IUPAC Name: trimethyl-[2-methyl-4-phenyldiazenyl-5-(2,3,4,5-tetrahydroxyheptylamino)phenyl]azanium Traditional Name: trimethyl-[2-methyl-4-phenylazo-5-(2,3,4,5-tetrahydroxyheptylamino)phenyl]ammonium Formula: C23H35N4O4+ MolecularWeight: 431.5484

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C(C(CNC1=C(C=C(C(=C1)[N+](C)(C)C)C)N=NC2=CC=CC=C2)O)O)O)O

Isomeric SMILES

CCC(C(C(C(CNC1=C(C=C(C(=C1)[N+](C)(C)C)C)N=NC2=CC=CC=C2)O)O)O)O

InChI

InChI=1S/C23H35N4O4/c1-6-20(28)22(30)23(31)21(29)14-24-17-13-19(27(3,4)5)15(2)12-18(17)26-25-16-10-8-7-9-11-16/h7-13,20-24,28-31H,6,14H2,1-5H3/q+1