N-[diphenylphosphanyl-(1-methanidylpyridin-1-ium-2-yl)methyl]-2,4,6-trimethyl-aniline

Systemtic Name: N-[diphenylphosphanyl-(1-methanidylpyridin-1-ium-2-yl)methyl]-2,4,6-trimethyl-aniline Openeye Name: N-[diphenylphosphanyl-(1-methanidylpyridin-1-ium-2-yl)methyl]-2,4,6-trimethyl-aniline CAS Name: N-[diphenylphosphino-(1-methanidyl-2-pyridin-1-iumyl)methyl]-2,4,6-trimethylaniline IUPAC Name: N-[diphenylphosphanyl-(1-methanidylpyridin-1-ium-2-yl)methyl]-2,4,6-trimethylaniline Traditional Name: [diphenylphosphino-(1-methanidylpyridin-1-ium-2-yl)methyl]-mesityl-amine Formula: C28H29N2P MolecularWeight: 424.517021

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(C2=CC=CC=[N+]2[CH2-])P(C3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(C2=CC=CC=[N+]2[CH2-])P(C3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C28H29N2P/c1-21-19-22(2)27(23(3)20-21)29-28(26-17-11-12-18-30(26)4)31(24-13-7-5-8-14-24)25-15-9-6-10-16-25/h5-20,28-29H,4H2,1-3H3