butyl-[(2S)-3-carbazol-9-yl-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: butyl-[(2S)-3-carbazol-9-yl-2-oxidanyl-propyl]-methyl-azanium Openeye Name: butyl-[(2S)-3-carbazol-9-yl-2-hydroxy-propyl]-methyl-ammonium CAS Name: butyl-[(2S)-3-(9-carbazolyl)-2-hydroxypropyl]-methylammonium IUPAC Name: butyl-[(2S)-3-carbazol-9-yl-2-hydroxypropyl]-methylazanium Traditional Name: butyl-[(2S)-3-carbazol-9-yl-2-hydroxy-propyl]-methyl-ammonium Formula: C20H27N2O+ MolecularWeight: 311.44118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)CC(CN1C2=CC=CC=C2C3=CC=CC=C31)O

Isomeric SMILES

CCCC[NH+](C)C[C@H](CN1C2=CC=CC=C2C3=CC=CC=C31)O

InChI

InChI=1S/C20H26N2O/c1-3-4-13-21(2)14-16(23)15-22-19-11-7-5-9-17(19)18-10-6-8-12-20(18)22/h5-12,16,23H,3-4,13-15H2,1-2H3/p+1/t16-/m1/s1