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

Systemtic Name: N-[(3-chloranyl-4-dodecoxy-phenyl)methyl]-2-methoxy-N-[(1-methylpyridin-1-ium-3-yl)methyl]benzamide Openeye Name: N-[(3-chloro-4-dodecoxy-phenyl)methyl]-2-methoxy-N-[(1-methylpyridin-1-ium-3-yl)methyl]benzamide CAS Name: N-[(3-chloro-4-dodecoxyphenyl)methyl]-2-methoxy-N-[(1-methyl-3-pyridin-1-iumyl)methyl]benzamide IUPAC Name: N-[(3-chloro-4-dodecoxyphenyl)methyl]-2-methoxy-N-[(1-methylpyridin-1-ium-3-yl)methyl]benzamide Traditional Name: N-(3-chloro-4-lauryloxy-benzyl)-2-methoxy-N-[(1-methylpyridin-1-ium-3-yl)methyl]benzamide Formula: C34H46ClN2O3+ MolecularWeight: 566.19364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)CN(CC2=C[N+](=CC=C2)C)C(=O)C3=CC=CC=C3OC)Cl

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)CN(CC2=C[N+](=CC=C2)C)C(=O)C3=CC=CC=C3OC)Cl

InChI

InChI=1S/C34H46ClN2O3/c1-4-5-6-7-8-9-10-11-12-15-23-40-33-21-20-28(24-31(33)35)26-37(27-29-17-16-22-36(2)25-29)34(38)30-18-13-14-19-32(30)39-3/h13-14,16-22,24-25H,4-12,15,23,26-27H2,1-3H3/q+1