1-[4-(2,5-dimethyl-1-oxidanyl-pyrrol-1-ium-1-yl)phenyl]ethanamine

Systemtic Name: 1-[4-(2,5-dimethyl-1-oxidanyl-pyrrol-1-ium-1-yl)phenyl]ethanamine Openeye Name: 1-[4-(1-hydroxy-2,5-dimethyl-pyrrol-1-ium-1-yl)phenyl]ethanamine CAS Name: 1-[4-(1-hydroxy-2,5-dimethyl-1-pyrrol-1-iumyl)phenyl]ethanamine IUPAC Name: 1-[4-(1-hydroxy-2,5-dimethylpyrrol-1-ium-1-yl)phenyl]ethanamine Traditional Name: 1-[4-(1-hydroxy-2,5-dimethyl-pyrrol-1-ium-1-yl)phenyl]ethylamine Formula: C14H19N2O+ MolecularWeight: 231.31346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C([N+]1(C2=CC=C(C=C2)C(C)N)O)C

Isomeric SMILES

CC1=CC=C([N+]1(C2=CC=C(C=C2)C(C)N)O)C

InChI

InChI=1S/C14H19N2O/c1-10-4-5-11(2)16(10,17)14-8-6-13(7-9-14)12(3)15/h4-9,12,17H,15H2,1-3H3/q+1