2-(4-methoxy-3-tetradecoxy-phenoxy)-N-[4-[(2-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]ethanamide bromide

Systemtic Name: 2-(4-methoxy-3-tetradecoxy-phenoxy)-N-[4-[(2-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]ethanamide bromide Openeye Name: 2-(4-methoxy-3-tetradecoxy-phenoxy)-N-[4-[(2-methylthiazol-3-ium-3-yl)methyl]phenyl]acetamide bromide CAS Name: 2-(4-methoxy-3-tetradecoxyphenoxy)-N-[4-[(2-methyl-3-thiazol-3-iumyl)methyl]phenyl]acetamide bromide IUPAC Name: 2-(4-methoxy-3-tetradecoxyphenoxy)-N-[4-[(2-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]acetamide bromide Traditional Name: 2-(4-methoxy-3-myristyloxy-phenoxy)-N-[4-[(2-methylthiazol-3-ium-3-yl)methyl]phenyl]acetamide bromide Formula: C34H49BrN2O4S MolecularWeight: 661.73286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H48N2O4S.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-23-39-33-25-31(20-21-32(33)38-3)40-27-34(37)35-30-18-16-29(17-19-30)26-36-22-24-41-28(36)2;/h16-22,24-25H,4-15,23,26-27H2,1-3H3;1H