2-chloranyl-N-[(1-methylpyridin-1-ium-3-yl)methyl]-4-tetradecoxy-benzamide

Systemtic Name: 2-chloranyl-N-[(1-methylpyridin-1-ium-3-yl)methyl]-4-tetradecoxy-benzamide Openeye Name: 2-chloro-N-[(1-methylpyridin-1-ium-3-yl)methyl]-4-tetradecoxy-benzamide CAS Name: 2-chloro-N-[(1-methyl-3-pyridin-1-iumyl)methyl]-4-tetradecoxybenzamide IUPAC Name: 2-chloro-N-[(1-methylpyridin-1-ium-3-yl)methyl]-4-tetradecoxybenzamide Traditional Name: 2-chloro-N-[(1-methylpyridin-1-ium-3-yl)methyl]-4-myristyloxy-benzamide Formula: C28H42ClN2O2+ MolecularWeight: 474.09828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC(=C(C=C1)C(=O)NCC2=C[N+](=CC=C2)C)Cl

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC(=C(C=C1)C(=O)NCC2=C[N+](=CC=C2)C)Cl

InChI

InChI=1S/C28H41ClN2O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-20-33-25-17-18-26(27(29)21-25)28(32)30-22-24-16-15-19-31(2)23-24/h15-19,21,23H,3-14,20,22H2,1-2H3/p+1