3-methoxypropyl-[(2R)-2-oxidanylpropyl]-[[1-(phenylmethyl)pyrrol-2-yl]methyl]azanium

Systemtic Name: 3-methoxypropyl-[(2R)-2-oxidanylpropyl]-[[1-(phenylmethyl)pyrrol-2-yl]methyl]azanium Openeye Name: (1-benzylpyrrol-2-yl)methyl-[(2R)-2-hydroxypropyl]-(3-methoxypropyl)ammonium CAS Name: [(2R)-2-hydroxypropyl]-(3-methoxypropyl)-[[1-(phenylmethyl)-2-pyrrolyl]methyl]ammonium IUPAC Name: (1-benzylpyrrol-2-yl)methyl-[(2R)-2-hydroxypropyl]-(3-methoxypropyl)azanium Traditional Name: (1-benzylpyrrol-2-yl)methyl-[(2R)-2-hydroxypropyl]-(3-methoxypropyl)ammonium Formula: C19H29N2O2+ MolecularWeight: 317.44576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+](CCCOC)CC1=CC=CN1CC2=CC=CC=C2)O

Isomeric SMILES

C[C@H](C[NH+](CCCOC)CC1=CC=CN1CC2=CC=CC=C2)O

InChI

InChI=1S/C19H28N2O2/c1-17(22)14-20(11-7-13-23-2)16-19-10-6-12-21(19)15-18-8-4-3-5-9-18/h3-6,8-10,12,17,22H,7,11,13-16H2,1-2H3/p+1/t17-/m1/s1