1-ethyl-2,3-dimethyl-3-(phenylmethyl)indol-1-ium perchlorate

Systemtic Name: 1-ethyl-2,3-dimethyl-3-(phenylmethyl)indol-1-ium perchlorate Openeye Name: 3-benzyl-1-ethyl-2,3-dimethyl-indol-1-ium perchlorate CAS Name: 1-ethyl-2,3-dimethyl-3-(phenylmethyl)indol-1-ium perchlorate IUPAC Name: 3-benzyl-1-ethyl-2,3-dimethylindol-1-ium perchlorate Traditional Name: 3-benzyl-1-ethyl-2,3-dimethyl-indol-1-ium perchlorate Formula: C19H22ClNO4 MolecularWeight: 363.83528

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C(C2=CC=CC=C21)(C)CC3=CC=CC=C3)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC[N+]1=C(C(C2=CC=CC=C21)(C)CC3=CC=CC=C3)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C19H22N.ClHO4/c1-4-20-15(2)19(3,14-16-10-6-5-7-11-16)17-12-8-9-13-18(17)20;2-1(3,4)5/h5-13H,4,14H2,1-3H3;(H,2,3,4,5)/q+1;/p-1