(2S)-N-(3-methylphenyl)-2-[4-(phenylmethyl)pyridin-1-ium-1-yl]propanamide

Systemtic Name: (2S)-N-(3-methylphenyl)-2-[4-(phenylmethyl)pyridin-1-ium-1-yl]propanamide Openeye Name: (2S)-2-(4-benzylpyridin-1-ium-1-yl)-N-(m-tolyl)propanamide CAS Name: (2S)-N-(3-methylphenyl)-2-[4-(phenylmethyl)-1-pyridin-1-iumyl]propanamide IUPAC Name: (2S)-2-(4-benzylpyridin-1-ium-1-yl)-N-(3-methylphenyl)propanamide Traditional Name: (2S)-2-(4-benzylpyridin-1-ium-1-yl)-N-(m-tolyl)propionamide Formula: C22H23N2O+ MolecularWeight: 331.43082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(C)[N+]2=CC=C(C=C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)[C@H](C)[N+]2=CC=C(C=C2)CC3=CC=CC=C3

InChI

InChI=1S/C22H22N2O/c1-17-7-6-10-21(15-17)23-22(25)18(2)24-13-11-20(12-14-24)16-19-8-4-3-5-9-19/h3-15,18H,16H2,1-2H3/p+1/t18-/m0/s1