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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=CC(=C1Cl)C(=O)NCC2=CC=CC=[N+]2C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=CC(=C1Cl)C(=O)NCC2=CC=CC=[N+]2C

InChI

InChI=1S/C28H41ClN2O2/c1-3-4-5-6-7-8-9-10-11-12-13-16-22-33-26-20-17-19-25(27(26)29)28(32)30-23-24-18-14-15-21-31(24)2/h14-15,17-21H,3-13,16,22-23H2,1-2H3/p+1