[(2S)-3-(2,3-dimethylindol-1-yl)-2-oxidanyl-propyl]-phenethyl-azanium

Systemtic Name: [(2S)-3-(2,3-dimethylindol-1-yl)-2-oxidanyl-propyl]-phenethyl-azanium Openeye Name: [(2S)-3-(2,3-dimethylindol-1-yl)-2-hydroxy-propyl]-phenethyl-ammonium CAS Name: [(2S)-3-(2,3-dimethyl-1-indolyl)-2-hydroxypropyl]-phenethylammonium IUPAC Name: [(2S)-3-(2,3-dimethylindol-1-yl)-2-hydroxypropyl]-phenethylazanium Traditional Name: [(2S)-3-(2,3-dimethylindol-1-yl)-2-hydroxy-propyl]-phenethyl-ammonium Formula: C21H27N2O+ MolecularWeight: 323.45188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=CC=CC=C12)CC(C[NH2+]CCC3=CC=CC=C3)O)C

Isomeric SMILES

CC1=C(N(C2=CC=CC=C12)C[C@H](C[NH2+]CCC3=CC=CC=C3)O)C

InChI

InChI=1S/C21H26N2O/c1-16-17(2)23(21-11-7-6-10-20(16)21)15-19(24)14-22-13-12-18-8-4-3-5-9-18/h3-11,19,22,24H,12-15H2,1-2H3/p+1/t19-/m0/s1