(2R)-1-(azepan-1-ium-1-yl)-3-(2,3-dimethylindol-1-yl)propan-2-ol

Systemtic Name: (2R)-1-(azepan-1-ium-1-yl)-3-(2,3-dimethylindol-1-yl)propan-2-ol Openeye Name: (2R)-1-(azepan-1-ium-1-yl)-3-(2,3-dimethylindol-1-yl)propan-2-ol CAS Name: (2R)-1-(1-azepan-1-iumyl)-3-(2,3-dimethyl-1-indolyl)-2-propanol IUPAC Name: (2R)-1-(azepan-1-ium-1-yl)-3-(2,3-dimethylindol-1-yl)propan-2-ol Traditional Name: (2R)-1-(azepan-1-ium-1-yl)-3-(2,3-dimethylindol-1-yl)propan-2-ol Formula: C19H29N2O+ MolecularWeight: 301.44636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=CC=CC=C12)CC(C[NH+]3CCCCCC3)O)C

Isomeric SMILES

CC1=C(N(C2=CC=CC=C12)C[C@H](C[NH+]3CCCCCC3)O)C

InChI

InChI=1S/C19H28N2O/c1-15-16(2)21(19-10-6-5-9-18(15)19)14-17(22)13-20-11-7-3-4-8-12-20/h5-6,9-10,17,22H,3-4,7-8,11-14H2,1-2H3/p+1/t17-/m0/s1