2-(4-methoxy-3-tetradecoxy-phenyl)-N-[4-(pyridin-1-ium-1-ylmethyl)phenyl]ethanamide bromide

Systemtic Name: 2-(4-methoxy-3-tetradecoxy-phenyl)-N-[4-(pyridin-1-ium-1-ylmethyl)phenyl]ethanamide bromide Openeye Name: 2-(4-methoxy-3-tetradecoxy-phenyl)-N-[4-(pyridin-1-ium-1-ylmethyl)phenyl]acetamide bromide CAS Name: 2-(4-methoxy-3-tetradecoxyphenyl)-N-[4-(1-pyridin-1-iumylmethyl)phenyl]acetamide bromide IUPAC Name: 2-(4-methoxy-3-tetradecoxyphenyl)-N-[4-(pyridin-1-ium-1-ylmethyl)phenyl]acetamide bromide Traditional Name: 2-(4-methoxy-3-myristyloxy-phenyl)-N-[4-(pyridin-1-ium-1-ylmethyl)phenyl]acetamide bromide Formula: C35H49BrN2O3 MolecularWeight: 625.67916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=CC(=C1)CC(=O)NC2=CC=C(C=C2)C[N+]3=CC=CC=C3)OC.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=CC(=C1)CC(=O)NC2=CC=C(C=C2)C[N+]3=CC=CC=C3)OC.[Br-]

InChI

InChI=1S/C35H48N2O3.BrH/c1-3-4-5-6-7-8-9-10-11-12-13-17-26-40-34-27-31(20-23-33(34)39-2)28-35(38)36-32-21-18-30(19-22-32)29-37-24-15-14-16-25-37;/h14-16,18-25,27H,3-13,17,26,28-29H2,1-2H3;1H