4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-N-(2,4,6-trimethylphenyl)benzamide

Systemtic Name: 4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-N-(2,4,6-trimethylphenyl)benzamide Openeye Name: 4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-N-(2,4,6-trimethylphenyl)benzamide CAS Name: 4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-N-(2,4,6-trimethylphenyl)benzamide IUPAC Name: 4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-N-(2,4,6-trimethylphenyl)benzamide Traditional Name: N-mesityl-4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)benzamide Formula: C26H29N2O+ MolecularWeight: 385.52126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC=C(C=C2)C[NH+]3CCC4=CC=CC=C4C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC=C(C=C2)C[NH+]3CCC4=CC=CC=C4C3)C

InChI

InChI=1S/C26H28N2O/c1-18-14-19(2)25(20(3)15-18)27-26(29)23-10-8-21(9-11-23)16-28-13-12-22-6-4-5-7-24(22)17-28/h4-11,14-15H,12-13,16-17H2,1-3H3,(H,27,29)/p+1