1-ethyl-2,3-dimethyl-3-phenyl-indol-1-ium perchlorate

Systemtic Name: 1-ethyl-2,3-dimethyl-3-phenyl-indol-1-ium perchlorate Openeye Name: 1-ethyl-2,3-dimethyl-3-phenyl-indol-1-ium perchlorate CAS Name: 1-ethyl-2,3-dimethyl-3-phenylindol-1-ium perchlorate IUPAC Name: 1-ethyl-2,3-dimethyl-3-phenylindol-1-ium perchlorate Traditional Name: 1-ethyl-2,3-dimethyl-3-phenyl-indol-1-ium perchlorate Formula: C18H20ClNO4 MolecularWeight: 349.8087

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N.ClHO4/c1-4-19-14(2)18(3,15-10-6-5-7-11-15)16-12-8-9-13-17(16)19;2-1(3,4)5/h5-13H,4H2,1-3H3;(H,2,3,4,5)/q+1;/p-1