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

Systemtic Name: 2-(3-methoxy-2-tetradecoxy-phenoxy)-N-[2-[(2-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]ethanamide bromide Openeye Name: 2-(3-methoxy-2-tetradecoxy-phenoxy)-N-[2-[(2-methylthiazol-3-ium-3-yl)methyl]phenyl]acetamide bromide CAS Name: 2-(3-methoxy-2-tetradecoxyphenoxy)-N-[2-[(2-methyl-3-thiazol-3-iumyl)methyl]phenyl]acetamide bromide IUPAC Name: 2-(3-methoxy-2-tetradecoxyphenoxy)-N-[2-[(2-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]acetamide bromide Traditional Name: 2-(3-methoxy-2-myristyloxy-phenoxy)-N-[2-[(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=C1OCC(=O)NC2=CC=CC=C2C[N+]3=C(SC=C3)C)OC.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=CC=C1OCC(=O)NC2=CC=CC=C2C[N+]3=C(SC=C3)C)OC.[Br-]

InChI

InChI=1S/C34H48N2O4S.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-17-24-39-34-31(38-3)21-18-22-32(34)40-27-33(37)35-30-20-16-15-19-29(30)26-36-23-25-41-28(36)2;/h15-16,18-23,25H,4-14,17,24,26-27H2,1-3H3;1H