[1-(3-methylphenyl)pyrrol-2-yl]methyl-[(2S)-2-oxidanylpropyl]azanium

Systemtic Name: [1-(3-methylphenyl)pyrrol-2-yl]methyl-[(2S)-2-oxidanylpropyl]azanium Openeye Name: [(2S)-2-hydroxypropyl]-[[1-(m-tolyl)pyrrol-2-yl]methyl]ammonium CAS Name: [(2S)-2-hydroxypropyl]-[[1-(3-methylphenyl)-2-pyrrolyl]methyl]ammonium IUPAC Name: [(2S)-2-hydroxypropyl]-[[1-(3-methylphenyl)pyrrol-2-yl]methyl]azanium Traditional Name: [(2S)-2-hydroxypropyl]-[[1-(m-tolyl)pyrrol-2-yl]methyl]ammonium Formula: C15H21N2O+ MolecularWeight: 245.34004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=CC=C2C[NH2+]CC(C)O

Isomeric SMILES

CC1=CC(=CC=C1)N2C=CC=C2C[NH2+]C[C@H](C)O

InChI

InChI=1S/C15H20N2O/c1-12-5-3-6-14(9-12)17-8-4-7-15(17)11-16-10-13(2)18/h3-9,13,16,18H,10-11H2,1-2H3/p+1/t13-/m0/s1