2-(3-tert-butyl-4-decoxy-phenoxy)-N-[3-[(4-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]ethanamide

Systemtic Name: 2-(3-tert-butyl-4-decoxy-phenoxy)-N-[3-[(4-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]ethanamide Openeye Name: 2-(3-tert-butyl-4-decoxy-phenoxy)-N-[3-[(4-methylthiazol-3-ium-3-yl)methyl]phenyl]acetamide CAS Name: 2-(3-tert-butyl-4-decoxyphenoxy)-N-[3-[(4-methyl-3-thiazol-3-iumyl)methyl]phenyl]acetamide IUPAC Name: 2-(3-tert-butyl-4-decoxyphenoxy)-N-[3-[(4-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]acetamide Traditional Name: 2-(3-tert-butyl-4-decoxy-phenoxy)-N-[3-[(4-methylthiazol-3-ium-3-yl)methyl]phenyl]acetamide Formula: C33H47N2O3S+ MolecularWeight: 551.80288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C=C(C=C1)OCC(=O)NC2=CC=CC(=C2)C[N+]3=CSC=C3C)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCOC1=C(C=C(C=C1)OCC(=O)NC2=CC=CC(=C2)C[N+]3=CSC=C3C)C(C)(C)C

InChI

InChI=1S/C33H46N2O3S/c1-6-7-8-9-10-11-12-13-19-37-31-18-17-29(21-30(31)33(3,4)5)38-23-32(36)34-28-16-14-15-27(20-28)22-35-25-39-24-26(35)2/h14-18,20-21,24-25H,6-13,19,22-23H2,1-5H3/p+1