(2S)-N-(4-ethylphenyl)-2-[4-(phenylmethyl)pyridin-1-ium-1-yl]propanamide

Systemtic Name: (2S)-N-(4-ethylphenyl)-2-[4-(phenylmethyl)pyridin-1-ium-1-yl]propanamide Openeye Name: (2S)-2-(4-benzylpyridin-1-ium-1-yl)-N-(4-ethylphenyl)propanamide CAS Name: (2S)-N-(4-ethylphenyl)-2-[4-(phenylmethyl)-1-pyridin-1-iumyl]propanamide IUPAC Name: (2S)-2-(4-benzylpyridin-1-ium-1-yl)-N-(4-ethylphenyl)propanamide Traditional Name: (2S)-2-(4-benzylpyridin-1-ium-1-yl)-N-(4-ethylphenyl)propionamide Formula: C23H25N2O+ MolecularWeight: 345.4574

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)[N+]2=CC=C(C=C2)CC3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)[C@H](C)[N+]2=CC=C(C=C2)CC3=CC=CC=C3

InChI

InChI=1S/C23H24N2O/c1-3-19-9-11-22(12-10-19)24-23(26)18(2)25-15-13-21(14-16-25)17-20-7-5-4-6-8-20/h4-16,18H,3,17H2,1-2H3/p+1/t18-/m0/s1