[(2S)-2-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-2-oxidanyl-ethyl]azanium

Systemtic Name: [(2S)-2-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-2-oxidanyl-ethyl]azanium Openeye Name: [(2S)-2-hydroxy-2-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)ethyl]ammonium CAS Name: [(2S)-2-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)-2-hydroxyethyl]ammonium IUPAC Name: [(2S)-2-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)-2-hydroxyethyl]azanium Traditional Name: [(2S)-2-hydroxy-2-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)ethyl]ammonium Formula: C11H21N2O+ MolecularWeight: 197.29724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C(C[NH3+])O

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)[C@@H](C[NH3+])O

InChI

InChI=1S/C11H20N2O/c1-7(2)13-8(3)5-10(9(13)4)11(14)6-12/h5,7,11,14H,6,12H2,1-4H3/p+1/t11-/m1/s1