4-dodecoxy-2-methoxy-N-[(1-methylpyridin-1-ium-4-yl)methyl]benzamide

Systemtic Name: 4-dodecoxy-2-methoxy-N-[(1-methylpyridin-1-ium-4-yl)methyl]benzamide Openeye Name: 4-dodecoxy-2-methoxy-N-[(1-methylpyridin-1-ium-4-yl)methyl]benzamide CAS Name: 4-dodecoxy-2-methoxy-N-[(1-methyl-4-pyridin-1-iumyl)methyl]benzamide IUPAC Name: 4-dodecoxy-2-methoxy-N-[(1-methylpyridin-1-ium-4-yl)methyl]benzamide Traditional Name: 4-lauryloxy-2-methoxy-N-[(1-methylpyridin-1-ium-4-yl)methyl]benzamide Formula: C27H41N2O3+ MolecularWeight: 441.62604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC(=C(C=C1)C(=O)NCC2=CC=[N+](C=C2)C)OC

Isomeric SMILES

CCCCCCCCCCCCOC1=CC(=C(C=C1)C(=O)NCC2=CC=[N+](C=C2)C)OC

InChI

InChI=1S/C27H40N2O3/c1-4-5-6-7-8-9-10-11-12-13-20-32-24-14-15-25(26(21-24)31-3)27(30)28-22-23-16-18-29(2)19-17-23/h14-19,21H,4-13,20,22H2,1-3H3/p+1