N-[(4-dodecoxy-3-methoxy-phenyl)methyl]-N-phenyl-1-propyl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-[(4-dodecoxy-3-methoxy-phenyl)methyl]-N-phenyl-1-propyl-pyridin-1-ium-3-carboxamide Openeye Name: N-[(4-dodecoxy-3-methoxy-phenyl)methyl]-N-phenyl-1-propyl-pyridin-1-ium-3-carboxamide CAS Name: N-[(4-dodecoxy-3-methoxyphenyl)methyl]-N-phenyl-1-propyl-3-pyridin-1-iumcarboxamide IUPAC Name: N-[(4-dodecoxy-3-methoxyphenyl)methyl]-N-phenyl-1-propylpyridin-1-ium-3-carboxamide Traditional Name: N-(4-lauryloxy-3-methoxy-benzyl)-N-phenyl-1-propyl-pyridin-1-ium-3-carboxamide Formula: C35H49N2O3+ MolecularWeight: 545.77516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)CN(C2=CC=CC=C2)C(=O)C3=C[N+](=CC=C3)CCC)OC

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)CN(C2=CC=CC=C2)C(=O)C3=C[N+](=CC=C3)CCC)OC

InChI

InChI=1S/C35H49N2O3/c1-4-6-7-8-9-10-11-12-13-17-26-40-33-23-22-30(27-34(33)39-3)28-37(32-20-15-14-16-21-32)35(38)31-19-18-25-36(29-31)24-5-2/h14-16,18-23,25,27,29H,4-13,17,24,26,28H2,1-3H3/q+1