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

Systemtic Name: 3-methoxy-N-[3-[(4-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]-2-tetradecoxy-benzamide bromide Openeye Name: 3-methoxy-N-[3-[(4-methylthiazol-3-ium-3-yl)methyl]phenyl]-2-tetradecoxy-benzamide bromide CAS Name: 3-methoxy-N-[3-[(4-methyl-3-thiazol-3-iumyl)methyl]phenyl]-2-tetradecoxybenzamide bromide IUPAC Name: 3-methoxy-N-[3-[(4-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]-2-tetradecoxybenzamide bromide Traditional Name: 3-methoxy-N-[3-[(4-methylthiazol-3-ium-3-yl)methyl]phenyl]-2-myristyloxy-benzamide bromide Formula: C33H47BrN2O3S MolecularWeight: 631.70688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=CC=C1OC)C(=O)NC2=CC=CC(=C2)C[N+]3=CSC=C3C.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=CC=C1OC)C(=O)NC2=CC=CC(=C2)C[N+]3=CSC=C3C.[Br-]

InChI

InChI=1S/C33H46N2O3S.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-22-38-32-30(20-17-21-31(32)37-3)33(36)34-29-19-16-18-28(23-29)24-35-26-39-25-27(35)2;/h16-21,23,25-26H,4-15,22,24H2,1-3H3;1H