ethyl-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-(3-methylbutyl)azanium

Systemtic Name: ethyl-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-(3-methylbutyl)azanium Openeye Name: ethyl-isopentyl-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]ammonium CAS Name: ethyl-[[1-[(3-methoxyphenyl)methyl]-2-pyrrolyl]methyl]-(3-methylbutyl)ammonium IUPAC Name: ethyl-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-(3-methylbutyl)azanium Traditional Name: ethyl-isoamyl-[(1-m-anisylpyrrol-2-yl)methyl]ammonium Formula: C20H31N2O+ MolecularWeight: 315.47294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCC(C)C)CC1=CC=CN1CC2=CC(=CC=C2)OC

Isomeric SMILES

CC[NH+](CCC(C)C)CC1=CC=CN1CC2=CC(=CC=C2)OC

InChI

InChI=1S/C20H30N2O/c1-5-21(13-11-17(2)3)16-19-9-7-12-22(19)15-18-8-6-10-20(14-18)23-4/h6-10,12,14,17H,5,11,13,15-16H2,1-4H3/p+1