[(2S)-2-oxidanyl-2-phenyl-ethyl]-[[1-(phenylmethyl)pyrrol-2-yl]methyl]-prop-2-enyl-azanium

Systemtic Name: [(2S)-2-oxidanyl-2-phenyl-ethyl]-[[1-(phenylmethyl)pyrrol-2-yl]methyl]-prop-2-enyl-azanium Openeye Name: allyl-[(1-benzylpyrrol-2-yl)methyl]-[(2S)-2-hydroxy-2-phenyl-ethyl]ammonium CAS Name: [(2S)-2-hydroxy-2-phenylethyl]-[[1-(phenylmethyl)-2-pyrrolyl]methyl]-prop-2-enylammonium IUPAC Name: (1-benzylpyrrol-2-yl)methyl-[(2S)-2-hydroxy-2-phenylethyl]-prop-2-enylazanium Traditional Name: allyl-[(1-benzylpyrrol-2-yl)methyl]-[(2S)-2-hydroxy-2-phenyl-ethyl]ammonium Formula: C23H27N2O+ MolecularWeight: 347.47328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+](CC1=CC=CN1CC2=CC=CC=C2)CC(C3=CC=CC=C3)O

Isomeric SMILES

C=CC[NH+](CC1=CC=CN1CC2=CC=CC=C2)C[C@H](C3=CC=CC=C3)O

InChI

InChI=1S/C23H26N2O/c1-2-15-24(19-23(26)21-12-7-4-8-13-21)18-22-14-9-16-25(22)17-20-10-5-3-6-11-20/h2-14,16,23,26H,1,15,17-19H2/p+1/t23-/m1/s1