N-cyclohexyl-4-ethoxy-2-(3-methoxyphenyl)-1,3-dimethyl-cyclohepta[c]pyrrol-2-ium-8-amine perchlorate

Systemtic Name: N-cyclohexyl-4-ethoxy-2-(3-methoxyphenyl)-1,3-dimethyl-cyclohepta[c]pyrrol-2-ium-8-amine perchlorate Openeye Name: N-cyclohexyl-4-ethoxy-2-(3-methoxyphenyl)-1,3-dimethyl-cyclohepta[c]pyrrol-2-ium-8-amine perchlorate CAS Name: N-cyclohexyl-4-ethoxy-2-(3-methoxyphenyl)-1,3-dimethyl-8-cyclohepta[c]pyrrol-2-iumamine perchlorate IUPAC Name: N-cyclohexyl-4-ethoxy-2-(3-methoxyphenyl)-1,3-dimethylcyclohepta[c]pyrrol-2-ium-8-amine perchlorate Traditional Name: cyclohexyl-[4-ethoxy-2-(3-methoxyphenyl)-1,3-dimethyl-cyclohepta[c]pyrrol-2-ium-8-yl]amine perchlorate Formula: C26H33ClN2O6 MolecularWeight: 505.00302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C2C1=C([N+](=C2C)C3=CC(=CC=C3)OC)C)NC4CCCCC4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCOC1=CC=CC(=C2C1=C([N+](=C2C)C3=CC(=CC=C3)OC)C)NC4CCCCC4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C26H32N2O2.ClHO4/c1-5-30-24-16-10-15-23(27-20-11-7-6-8-12-20)25-18(2)28(19(3)26(24)25)21-13-9-14-22(17-21)29-4;2-1(3,4)5/h9-10,13-17,20H,5-8,11-12H2,1-4H3;(H,2,3,4,5)