2-[[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrrol-2-yl]carbonyl-(phenylmethyl)amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrrol-2-yl]carbonyl-(phenylmethyl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[benzyl-[3,5-dimethyl-1-(p-tolylmethyl)pyrrole-2-carbonyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[3,5-dimethyl-1-[(4-methylphenyl)methyl]-2-pyrrolyl]-oxomethyl]-(phenylmethyl)amino]ethyl-dimethylammonium IUPAC Name: 2-[benzyl-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrrole-2-carbonyl]amino]ethyl-dimethylazanium Traditional Name: 2-[benzyl-[3,5-dimethyl-1-(4-methylbenzyl)pyrrole-2-carbonyl]amino]ethyl-dimethyl-ammonium Formula: C26H34N3O+ MolecularWeight: 404.56766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=CC(=C2C(=O)N(CC[NH+](C)C)CC3=CC=CC=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=CC(=C2C(=O)N(CC[NH+](C)C)CC3=CC=CC=C3)C)C

InChI

InChI=1S/C26H33N3O/c1-20-11-13-24(14-12-20)19-29-22(3)17-21(2)25(29)26(30)28(16-15-27(4)5)18-23-9-7-6-8-10-23/h6-14,17H,15-16,18-19H2,1-5H3/p+1