(2-hydroxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone

Systemtic Name: (2-hydroxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Openeye Name: (2-hydroxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone CAS Name: (2-hydroxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone IUPAC Name: (2-hydroxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Traditional Name: (2-hydroxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Formula: C13H19N2O2+ MolecularWeight: 235.30216

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C(=O)C2=CC=CC=C2O

Isomeric SMILES

C[NH+]1CCCN(CC1)C(=O)C2=CC=CC=C2O

InChI

InChI=1S/C13H18N2O2/c1-14-7-4-8-15(10-9-14)13(17)11-5-2-3-6-12(11)16/h2-3,5-6,16H,4,7-10H2,1H3/p+1