[(2S)-2-(4-ethylphenyl)-2-oxidanyl-ethyl]-propan-2-yl-azanium

Systemtic Name: [(2S)-2-(4-ethylphenyl)-2-oxidanyl-ethyl]-propan-2-yl-azanium Openeye Name: [(2S)-2-(4-ethylphenyl)-2-hydroxy-ethyl]-isopropyl-ammonium CAS Name: [(2S)-2-(4-ethylphenyl)-2-hydroxyethyl]-propan-2-ylammonium IUPAC Name: [(2S)-2-(4-ethylphenyl)-2-hydroxyethyl]-propan-2-ylazanium Traditional Name: [(2S)-2-(4-ethylphenyl)-2-hydroxy-ethyl]-isopropyl-ammonium Formula: C13H22NO+ MolecularWeight: 208.31988

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C[NH2+]C(C)C)O

Isomeric SMILES

CCC1=CC=C(C=C1)[C@@H](C[NH2+]C(C)C)O

InChI

InChI=1S/C13H21NO/c1-4-11-5-7-12(8-6-11)13(15)9-14-10(2)3/h5-8,10,13-15H,4,9H2,1-3H3/p+1/t13-/m1/s1