N-[(4-dodecoxy-3-methoxy-phenyl)methyl]-N-phenyl-1-propyl-pyridin-1-ium-2-carboxamide

Systemtic Name: N-[(4-dodecoxy-3-methoxy-phenyl)methyl]-N-phenyl-1-propyl-pyridin-1-ium-2-carboxamide Openeye Name: N-[(4-dodecoxy-3-methoxy-phenyl)methyl]-N-phenyl-1-propyl-pyridin-1-ium-2-carboxamide CAS Name: N-[(4-dodecoxy-3-methoxyphenyl)methyl]-N-phenyl-1-propyl-2-pyridin-1-iumcarboxamide IUPAC Name: N-[(4-dodecoxy-3-methoxyphenyl)methyl]-N-phenyl-1-propylpyridin-1-ium-2-carboxamide Traditional Name: N-(4-lauryloxy-3-methoxy-benzyl)-N-phenyl-1-propyl-pyridin-1-ium-2-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=CC=CC=[N+]3CCC)OC

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)CN(C2=CC=CC=C2)C(=O)C3=CC=CC=[N+]3CCC)OC

InChI

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