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

Systemtic Name: 4-ethoxy-2-(4-methoxyphenyl)-1,3-dimethyl-N-(phenylmethyl)cyclohepta[c]pyrrol-2-ium-8-amine Openeye Name: N-benzyl-4-ethoxy-2-(4-methoxyphenyl)-1,3-dimethyl-cyclohepta[c]pyrrol-2-ium-8-amine CAS Name: 4-ethoxy-2-(4-methoxyphenyl)-1,3-dimethyl-N-(phenylmethyl)-8-cyclohepta[c]pyrrol-2-iumamine IUPAC Name: N-benzyl-4-ethoxy-2-(4-methoxyphenyl)-1,3-dimethylcyclohepta[c]pyrrol-2-ium-8-amine Traditional Name: benzyl-[4-ethoxy-2-(4-methoxyphenyl)-1,3-dimethyl-cyclohepta[c]pyrrol-2-ium-8-yl]amine Formula: C27H29N2O2+ MolecularWeight: 413.53136

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C2C1=C([N+](=C2C)C3=CC=C(C=C3)OC)C)NCC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=CC(=C2C1=C([N+](=C2C)C3=CC=C(C=C3)OC)C)NCC4=CC=CC=C4

InChI

InChI=1S/C27H28N2O2/c1-5-31-25-13-9-12-24(28-18-21-10-7-6-8-11-21)26-19(2)29(20(3)27(25)26)22-14-16-23(30-4)17-15-22/h6-17H,5,18H2,1-4H3/p+1