[(E)-(5-diphenylphosphoryl-1-methyl-pyrrol-2-yl)methylideneamino]-ethyl-dimethyl-azanium iodide

Systemtic Name: [(E)-(5-diphenylphosphoryl-1-methyl-pyrrol-2-yl)methylideneamino]-ethyl-dimethyl-azanium iodide Openeye Name: [(E)-(5-diphenylphosphoryl-1-methyl-pyrrol-2-yl)methyleneamino]-ethyl-dimethyl-ammonium iodide CAS Name: [(E)-(5-diphenylphosphoryl-1-methyl-2-pyrrolyl)methylideneamino]-ethyl-dimethylammonium iodide IUPAC Name: [(E)-(5-diphenylphosphoryl-1-methylpyrrol-2-yl)methylideneamino]-ethyl-dimethylazanium iodide Traditional Name: [(E)-(5-diphenylphosphoryl-1-methyl-pyrrol-2-yl)methyleneamino]-ethyl-dimethyl-ammonium iodide Formula: C22H27IN3OP MolecularWeight: 507.347511

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(C)N=CC1=CC=C(N1C)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3.[I-]

Isomeric SMILES

CC[N+](C)(C)/N=C/C1=CC=C(N1C)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3.[I-]

InChI

InChI=1S/C22H27N3OP.HI/c1-5-25(3,4)23-18-19-16-17-22(24(19)2)27(26,20-12-8-6-9-13-20)21-14-10-7-11-15-21;/h6-18H,5H2,1-4H3;1H/q+1;/p-1/b23-18+;