2-(3-methoxy-4-tetradecoxy-phenoxy)-3-oxidanylidene-N-[(1-propylpyridin-1-ium-2-yl)methyl]butanamide iodide

Systemtic Name: 2-(3-methoxy-4-tetradecoxy-phenoxy)-3-oxidanylidene-N-[(1-propylpyridin-1-ium-2-yl)methyl]butanamide iodide Openeye Name: 2-(3-methoxy-4-tetradecoxy-phenoxy)-3-oxo-N-[(1-propylpyridin-1-ium-2-yl)methyl]butanamide iodide CAS Name: 2-(3-methoxy-4-tetradecoxyphenoxy)-3-oxo-N-[(1-propyl-2-pyridin-1-iumyl)methyl]butanamide iodide IUPAC Name: 2-(3-methoxy-4-tetradecoxyphenoxy)-3-oxo-N-[(1-propylpyridin-1-ium-2-yl)methyl]butanamide iodide Traditional Name: 3-keto-2-(3-methoxy-4-myristyloxy-phenoxy)-N-[(1-propylpyridin-1-ium-2-yl)methyl]butyramide iodide Formula: C34H53IN2O5 MolecularWeight: 696.69949

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)OC(C(=O)C)C(=O)NCC2=CC=CC=[N+]2CCC)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)OC(C(=O)C)C(=O)NCC2=CC=CC=[N+]2CCC)OC.[I-]

InChI

InChI=1S/C34H52N2O5.HI/c1-5-7-8-9-10-11-12-13-14-15-16-19-25-40-31-22-21-30(26-32(31)39-4)41-33(28(3)37)34(38)35-27-29-20-17-18-24-36(29)23-6-2;/h17-18,20-22,24,26,33H,5-16,19,23,25,27H2,1-4H3;1H