2-[[1-(3-methylphenyl)pyrrol-2-yl]methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 2-[[1-(3-methylphenyl)pyrrol-2-yl]methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 2-[[1-(m-tolyl)pyrrol-2-yl]methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 2-[[1-(3-methylphenyl)-2-pyrrolyl]methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 2-[[1-(3-methylphenyl)pyrrol-2-yl]methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 2-[[1-(m-tolyl)pyrrol-2-yl]methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C21H23N2+ MolecularWeight: 303.42072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=CC=C2C[NH+]3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC(=CC=C1)N2C=CC=C2C[NH+]3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H22N2/c1-17-6-4-9-20(14-17)23-12-5-10-21(23)16-22-13-11-18-7-2-3-8-19(18)15-22/h2-10,12,14H,11,13,15-16H2,1H3/p+1