[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl-[(2S)-2-oxidanylpropyl]-prop-2-enyl-azanium

Systemtic Name: [1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl-[(2S)-2-oxidanylpropyl]-prop-2-enyl-azanium Openeye Name: allyl-[(2S)-2-hydroxypropyl]-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]ammonium CAS Name: [(2S)-2-hydroxypropyl]-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]-prop-2-enylammonium IUPAC Name: [(2S)-2-hydroxypropyl]-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-prop-2-enylazanium Traditional Name: allyl-[(2S)-2-hydroxypropyl]-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]ammonium Formula: C19H27N2O+ MolecularWeight: 299.43048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=CC=C2C[NH+](CC=C)CC(C)O

Isomeric SMILES

CC1=CC=CC=C1CN2C=CC=C2C[NH+](CC=C)C[C@H](C)O

InChI

InChI=1S/C19H26N2O/c1-4-11-20(13-17(3)22)15-19-10-7-12-21(19)14-18-9-6-5-8-16(18)2/h4-10,12,17,22H,1,11,13-15H2,2-3H3/p+1/t17-/m0/s1