N-ethanoyl-4-methoxy-N-[(1-propylpyridin-1-ium-2-yl)methyl]-3-tetradecoxy-benzamide

Systemtic Name: N-ethanoyl-4-methoxy-N-[(1-propylpyridin-1-ium-2-yl)methyl]-3-tetradecoxy-benzamide Openeye Name: N-acetyl-4-methoxy-N-[(1-propylpyridin-1-ium-2-yl)methyl]-3-tetradecoxy-benzamide CAS Name: N-acetyl-4-methoxy-N-[(1-propyl-2-pyridin-1-iumyl)methyl]-3-tetradecoxybenzamide IUPAC Name: N-acetyl-4-methoxy-N-[(1-propylpyridin-1-ium-2-yl)methyl]-3-tetradecoxybenzamide Traditional Name: N-acetyl-4-methoxy-3-myristyloxy-N-[(1-propylpyridin-1-ium-2-yl)methyl]benzamide Formula: C33H51N2O4+ MolecularWeight: 539.76904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=CC(=C1)C(=O)N(CC2=CC=CC=[N+]2CCC)C(=O)C)OC

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=CC(=C1)C(=O)N(CC2=CC=CC=[N+]2CCC)C(=O)C)OC

InChI

InChI=1S/C33H51N2O4/c1-5-7-8-9-10-11-12-13-14-15-16-19-25-39-32-26-29(21-22-31(32)38-4)33(37)35(28(3)36)27-30-20-17-18-24-34(30)23-6-2/h17-18,20-22,24,26H,5-16,19,23,25,27H2,1-4H3/q+1