2-(4-hexadecoxy-2-methoxy-phenyl)-N-[(1-propylpyridin-1-ium-3-yl)methyl]ethanamide

Systemtic Name: 2-(4-hexadecoxy-2-methoxy-phenyl)-N-[(1-propylpyridin-1-ium-3-yl)methyl]ethanamide Openeye Name: 2-(4-hexadecoxy-2-methoxy-phenyl)-N-[(1-propylpyridin-1-ium-3-yl)methyl]acetamide CAS Name: 2-(4-hexadecoxy-2-methoxyphenyl)-N-[(1-propyl-3-pyridin-1-iumyl)methyl]acetamide IUPAC Name: 2-(4-hexadecoxy-2-methoxyphenyl)-N-[(1-propylpyridin-1-ium-3-yl)methyl]acetamide Traditional Name: 2-(4-cetyloxy-2-methoxy-phenyl)-N-[(1-propylpyridin-1-ium-3-yl)methyl]acetamide Formula: C34H55N2O3+ MolecularWeight: 539.8121

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC(=C(C=C1)CC(=O)NCC2=C[N+](=CC=C2)CCC)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC(=C(C=C1)CC(=O)NCC2=C[N+](=CC=C2)CCC)OC

InChI

InChI=1S/C34H54N2O3/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-25-39-32-22-21-31(33(27-32)38-3)26-34(37)35-28-30-20-19-24-36(29-30)23-5-2/h19-22,24,27,29H,4-18,23,25-26,28H2,1-3H3/p+1