2-(4-chloranyl-2-methyl-phenoxy)-N-(pyridin-1-ium-4-ylmethyl)propanamide

Systemtic Name: 2-(4-chloranyl-2-methyl-phenoxy)-N-(pyridin-1-ium-4-ylmethyl)propanamide Openeye Name: 2-(4-chloro-2-methyl-phenoxy)-N-(pyridin-1-ium-4-ylmethyl)propanamide CAS Name: 2-(4-chloro-2-methylphenoxy)-N-(4-pyridin-1-iumylmethyl)propanamide IUPAC Name: 2-(4-chloro-2-methylphenoxy)-N-(pyridin-1-ium-4-ylmethyl)propanamide Traditional Name: 2-(4-chloro-2-methyl-phenoxy)-N-(pyridin-1-ium-4-ylmethyl)propionamide Formula: C16H18ClN2O2+ MolecularWeight: 305.77932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OC(C)C(=O)NCC2=CC=[NH+]C=C2

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OC(C)C(=O)NCC2=CC=[NH+]C=C2

InChI

InChI=1S/C16H17ClN2O2/c1-11-9-14(17)3-4-15(11)21-12(2)16(20)19-10-13-5-7-18-8-6-13/h3-9,12H,10H2,1-2H3,(H,19,20)/p+1