[1-[(4-tert-butylphenyl)methyl]pyrrol-2-yl]methyl-(2-methyl-1-oxidanyl-propan-2-yl)-prop-2-enyl-azanium

Systemtic Name: [1-[(4-tert-butylphenyl)methyl]pyrrol-2-yl]methyl-(2-methyl-1-oxidanyl-propan-2-yl)-prop-2-enyl-azanium Openeye Name: allyl-[[1-[(4-tert-butylphenyl)methyl]pyrrol-2-yl]methyl]-(2-hydroxy-1,1-dimethyl-ethyl)ammonium CAS Name: [1-[(4-tert-butylphenyl)methyl]-2-pyrrolyl]methyl-(1-hydroxy-2-methylpropan-2-yl)-prop-2-enylammonium IUPAC Name: [1-[(4-tert-butylphenyl)methyl]pyrrol-2-yl]methyl-(1-hydroxy-2-methylpropan-2-yl)-prop-2-enylazanium Traditional Name: allyl-[[1-(4-tert-butylbenzyl)pyrrol-2-yl]methyl]-(2-hydroxy-1,1-dimethyl-ethyl)ammonium Formula: C23H35N2O+ MolecularWeight: 355.5368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C=CC=C2C[NH+](CC=C)C(C)(C)CO

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C=CC=C2C[NH+](CC=C)C(C)(C)CO

InChI

InChI=1S/C23H34N2O/c1-7-14-25(23(5,6)18-26)17-21-9-8-15-24(21)16-19-10-12-20(13-11-19)22(2,3)4/h7-13,15,26H,1,14,16-18H2,2-6H3/p+1