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

Systemtic Name: N-[(1-methylpyridin-1-ium-2-yl)methyl]-4-(4-pentoxyphenyl)benzamide Openeye Name: N-[(1-methylpyridin-1-ium-2-yl)methyl]-4-(4-pentoxyphenyl)benzamide CAS Name: N-[(1-methyl-2-pyridin-1-iumyl)methyl]-4-(4-pentoxyphenyl)benzamide IUPAC Name: N-[(1-methylpyridin-1-ium-2-yl)methyl]-4-(4-pentoxyphenyl)benzamide Traditional Name: 4-(4-amoxyphenyl)-N-[(1-methylpyridin-1-ium-2-yl)methyl]benzamide Formula: C25H29N2O2+ MolecularWeight: 389.50996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NCC3=CC=CC=[N+]3C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NCC3=CC=CC=[N+]3C

InChI

InChI=1S/C25H28N2O2/c1-3-4-7-18-29-24-15-13-21(14-16-24)20-9-11-22(12-10-20)25(28)26-19-23-8-5-6-17-27(23)2/h5-6,8-17H,3-4,7,18-19H2,1-2H3/p+1