[2,5-dimethyl-1-(4-oxidanylbutan-2-yl)pyrrol-1-ium-1-yl]-(3-hydroxyphenyl)methanone

Systemtic Name: [2,5-dimethyl-1-(4-oxidanylbutan-2-yl)pyrrol-1-ium-1-yl]-(3-hydroxyphenyl)methanone Openeye Name: [1-(3-hydroxy-1-methyl-propyl)-2,5-dimethyl-pyrrol-1-ium-1-yl]-(3-hydroxyphenyl)methanone CAS Name: [1-(4-hydroxybutan-2-yl)-2,5-dimethyl-1-pyrrol-1-iumyl]-(3-hydroxyphenyl)methanone IUPAC Name: [1-(4-hydroxybutan-2-yl)-2,5-dimethylpyrrol-1-ium-1-yl]-(3-hydroxyphenyl)methanone Traditional Name: [1-(3-hydroxy-1-methyl-propyl)-2,5-dimethyl-pyrrol-1-ium-1-yl]-(3-hydroxyphenyl)methanone Formula: C17H22NO3+ MolecularWeight: 288.36148

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO3/c1-12-7-8-13(2)18(12,14(3)9-10-19)17(21)15-5-4-6-16(20)11-15/h4-8,11,14,19H,9-10H2,1-3H3/p+1