2-methoxyethyl-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-[(2R)-2-oxidanylpentyl]azanium

Systemtic Name: 2-methoxyethyl-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-[(2R)-2-oxidanylpentyl]azanium Openeye Name: [(2R)-2-hydroxypentyl]-(2-methoxyethyl)-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]ammonium CAS Name: [(2R)-2-hydroxypentyl]-(2-methoxyethyl)-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]ammonium IUPAC Name: [(2R)-2-hydroxypentyl]-(2-methoxyethyl)-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]azanium Traditional Name: [(2R)-2-hydroxypentyl]-(2-methoxyethyl)-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]ammonium Formula: C21H33N2O2+ MolecularWeight: 345.49892

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C[NH+](CCOC)CC1=CC=CN1CC2=CC=CC=C2C)O

Isomeric SMILES

CCC[C@H](C[NH+](CCOC)CC1=CC=CN1CC2=CC=CC=C2C)O

InChI

InChI=1S/C21H32N2O2/c1-4-8-21(24)17-22(13-14-25-3)16-20-11-7-12-23(20)15-19-10-6-5-9-18(19)2/h5-7,9-12,21,24H,4,8,13-17H2,1-3H3/p+1/t21-/m1/s1