(2S)-1-(7-chloranyl-2,3-dimethyl-indol-1-yl)-3-piperidin-1-ium-1-yl-propan-2-ol

Systemtic Name: (2S)-1-(7-chloranyl-2,3-dimethyl-indol-1-yl)-3-piperidin-1-ium-1-yl-propan-2-ol Openeye Name: (2S)-1-(7-chloro-2,3-dimethyl-indol-1-yl)-3-piperidin-1-ium-1-yl-propan-2-ol CAS Name: (2S)-1-(7-chloro-2,3-dimethyl-1-indolyl)-3-(1-piperidin-1-iumyl)-2-propanol IUPAC Name: (2S)-1-(7-chloro-2,3-dimethylindol-1-yl)-3-piperidin-1-ium-1-ylpropan-2-ol Traditional Name: (2S)-1-(7-chloro-2,3-dimethyl-indol-1-yl)-3-piperidin-1-ium-1-yl-propan-2-ol Formula: C18H26ClN2O+ MolecularWeight: 321.86484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=CC=C2Cl)CC(C[NH+]3CCCCC3)O)C

Isomeric SMILES

CC1=C(N(C2=C1C=CC=C2Cl)C[C@@H](C[NH+]3CCCCC3)O)C

InChI

InChI=1S/C18H25ClN2O/c1-13-14(2)21(18-16(13)7-6-8-17(18)19)12-15(22)11-20-9-4-3-5-10-20/h6-8,15,22H,3-5,9-12H2,1-2H3/p+1/t15-/m1/s1