N-(3-ethanoyl-4-tetradecoxy-phenyl)-3-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]benzamide bromide

Systemtic Name: N-(3-ethanoyl-4-tetradecoxy-phenyl)-3-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]benzamide bromide Openeye Name: N-(3-acetyl-4-tetradecoxy-phenyl)-3-[(5-methylthiazol-3-ium-3-yl)methyl]benzamide bromide CAS Name: N-(3-acetyl-4-tetradecoxyphenyl)-3-[(5-methyl-3-thiazol-3-iumyl)methyl]benzamide bromide IUPAC Name: N-(3-acetyl-4-tetradecoxyphenyl)-3-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]benzamide bromide Traditional Name: N-(3-acetyl-4-myristyloxy-phenyl)-3-[(5-methylthiazol-3-ium-3-yl)methyl]benzamide bromide Formula: C34H47BrN2O3S MolecularWeight: 643.71758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H46N2O3S.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-21-39-33-20-19-31(23-32(33)28(3)37)35-34(38)30-18-16-17-29(22-30)25-36-24-27(2)40-26-36;/h16-20,22-24,26H,4-15,21,25H2,1-3H3;1H