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

Systemtic Name: [(2S)-3-(2,3-dimethylindol-1-yl)-2-oxidanyl-propyl]-(3-oxidanylpropyl)azanium Openeye Name: [(2S)-3-(2,3-dimethylindol-1-yl)-2-hydroxy-propyl]-(3-hydroxypropyl)ammonium CAS Name: [(2S)-3-(2,3-dimethyl-1-indolyl)-2-hydroxypropyl]-(3-hydroxypropyl)ammonium IUPAC Name: [(2S)-3-(2,3-dimethylindol-1-yl)-2-hydroxypropyl]-(3-hydroxypropyl)azanium Traditional Name: [(2S)-3-(2,3-dimethylindol-1-yl)-2-hydroxy-propyl]-(3-hydroxypropyl)ammonium Formula: C16H25N2O2+ MolecularWeight: 277.3819

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O2/c1-12-13(2)18(16-7-4-3-6-15(12)16)11-14(20)10-17-8-5-9-19/h3-4,6-7,14,17,19-20H,5,8-11H2,1-2H3/p+1/t14-/m0/s1