chloranylmethane; 2-[2-(2-phenylindolizin-3-yl)pyridin-1-ium-1-yl]ethanal

Systemtic Name: chloranylmethane; 2-[2-(2-phenylindolizin-3-yl)pyridin-1-ium-1-yl]ethanal Openeye Name: chloromethane; 2-[2-(2-phenylindolizin-3-yl)pyridin-1-ium-1-yl]acetaldehyde CAS Name: chloromethane; 2-[2-(2-phenyl-3-indolizinyl)-1-pyridin-1-iumyl]acetaldehyde IUPAC Name: chloromethane; 2-[2-(2-phenylindolizin-3-yl)pyridin-1-ium-1-yl]acetaldehyde Traditional Name: chloromethane; 2-[2-(2-phenylindolizin-3-yl)pyridin-1-ium-1-yl]acetaldehyde Formula: C22H20ClN2O+ MolecularWeight: 363.86

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Descriptors Computed from Structure

Canonical SMILES:

CCl.C1=CC=C(C=C1)C2=C(N3C=CC=CC3=C2)C4=CC=CC=[N+]4CC=O

Isomeric SMILES

CCl.C1=CC=C(C=C1)C2=C(N3C=CC=CC3=C2)C4=CC=CC=[N+]4CC=O

InChI

InChI=1S/C21H17N2O.CH3Cl/c24-15-14-22-12-6-5-11-20(22)21-19(17-8-2-1-3-9-17)16-18-10-4-7-13-23(18)21;1-2/h1-13,15-16H,14H2;1H3/q+1;