[(E)-[[1-[(2-oxidanylidene-2-propan-2-yloxy-ethyl)carbamoyl]benzimidazol-2-yl]amino]diazenyl]-triphenyl-phosphanium

Systemtic Name: [(E)-[[1-[(2-oxidanylidene-2-propan-2-yloxy-ethyl)carbamoyl]benzimidazol-2-yl]amino]diazenyl]-triphenyl-phosphanium Openeye Name: [(E)-[[1-[(2-isopropoxy-2-oxo-ethyl)carbamoyl]benzimidazol-2-yl]amino]azo]-triphenyl-phosphonium CAS Name: [(E)-[[1-[oxo-[(2-oxo-2-propan-2-yloxyethyl)amino]methyl]-2-benzimidazolyl]amino]azo]-triphenylphosphonium IUPAC Name: [(E)-[[1-[(2-oxo-2-propan-2-yloxyethyl)carbamoyl]benzimidazol-2-yl]amino]diazenyl]-triphenylphosphanium Traditional Name: [(E)-[[1-[(2-isopropoxy-2-keto-ethyl)carbamoyl]benzimidazol-2-yl]amino]azo]-triphenyl-phosphonium Formula: C31H30N6O3P+ MolecularWeight: 565.582061

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CNC(=O)N1C2=CC=CC=C2N=C1NN=N[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)OC(=O)CNC(=O)N1C2=CC=CC=C2N=C1N/N=N/[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H29N6O3P/c1-23(2)40-29(38)22-32-31(39)37-28-21-13-12-20-27(28)33-30(37)34-35-36-41(24-14-6-3-7-15-24,25-16-8-4-9-17-25)26-18-10-5-11-19-26/h3-21,23H,22H2,1-2H3,(H-,32,33,34,36,39)/p+1