1-[(2S)-2-oxidanyl-3-(2,3,5-trimethylindol-1-yl)propyl]piperidin-1-ium-4-ol

Systemtic Name: 1-[(2S)-2-oxidanyl-3-(2,3,5-trimethylindol-1-yl)propyl]piperidin-1-ium-4-ol Openeye Name: 1-[(2S)-2-hydroxy-3-(2,3,5-trimethylindol-1-yl)propyl]piperidin-1-ium-4-ol CAS Name: 1-[(2S)-2-hydroxy-3-(2,3,5-trimethyl-1-indolyl)propyl]-4-piperidin-1-iumol IUPAC Name: 1-[(2S)-2-hydroxy-3-(2,3,5-trimethylindol-1-yl)propyl]piperidin-1-ium-4-ol Traditional Name: 1-[(2S)-2-hydroxy-3-(2,3,5-trimethylindol-1-yl)propyl]piperidin-1-ium-4-ol Formula: C19H29N2O2+ MolecularWeight: 317.44576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2C)C)CC(C[NH+]3CCC(CC3)O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2C)C)C[C@@H](C[NH+]3CCC(CC3)O)O

InChI

InChI=1S/C19H28N2O2/c1-13-4-5-19-18(10-13)14(2)15(3)21(19)12-17(23)11-20-8-6-16(22)7-9-20/h4-5,10,16-17,22-23H,6-9,11-12H2,1-3H3/p+1/t17-/m1/s1