[(2R)-2-oxidanylpropyl]-[[1-(phenylmethyl)pyrrol-2-yl]methyl]-prop-2-enyl-azanium

Systemtic Name: [(2R)-2-oxidanylpropyl]-[[1-(phenylmethyl)pyrrol-2-yl]methyl]-prop-2-enyl-azanium Openeye Name: allyl-[(1-benzylpyrrol-2-yl)methyl]-[(2R)-2-hydroxypropyl]ammonium CAS Name: [(2R)-2-hydroxypropyl]-[[1-(phenylmethyl)-2-pyrrolyl]methyl]-prop-2-enylammonium IUPAC Name: (1-benzylpyrrol-2-yl)methyl-[(2R)-2-hydroxypropyl]-prop-2-enylazanium Traditional Name: allyl-[(1-benzylpyrrol-2-yl)methyl]-[(2R)-2-hydroxypropyl]ammonium Formula: C18H25N2O+ MolecularWeight: 285.4039

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N2O/c1-3-11-19(13-16(2)21)15-18-10-7-12-20(18)14-17-8-5-4-6-9-17/h3-10,12,16,21H,1,11,13-15H2,2H3/p+1/t16-/m1/s1