4-propan-2-yl-N-(pyridin-1-ium-2-ylmethyl)benzamide

Systemtic Name: 4-propan-2-yl-N-(pyridin-1-ium-2-ylmethyl)benzamide Openeye Name: 4-isopropyl-N-(pyridin-1-ium-2-ylmethyl)benzamide CAS Name: 4-propan-2-yl-N-(2-pyridin-1-iumylmethyl)benzamide IUPAC Name: 4-propan-2-yl-N-(pyridin-1-ium-2-ylmethyl)benzamide Traditional Name: 4-isopropyl-N-(pyridin-1-ium-2-ylmethyl)benzamide Formula: C16H19N2O+ MolecularWeight: 255.33486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)NCC2=CC=CC=[NH+]2

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)NCC2=CC=CC=[NH+]2

InChI

InChI=1S/C16H18N2O/c1-12(2)13-6-8-14(9-7-13)16(19)18-11-15-5-3-4-10-17-15/h3-10,12H,11H2,1-2H3,(H,18,19)/p+1