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

Systemtic Name: N-(3-ethanoyl-2-tetradecoxy-phenyl)-2-[(4-methyl-1,3-thiazol-3-ium-3-yl)methyl]benzamide bromide Openeye Name: N-(3-acetyl-2-tetradecoxy-phenyl)-2-[(4-methylthiazol-3-ium-3-yl)methyl]benzamide bromide CAS Name: N-(3-acetyl-2-tetradecoxyphenyl)-2-[(4-methyl-3-thiazol-3-iumyl)methyl]benzamide bromide IUPAC Name: N-(3-acetyl-2-tetradecoxyphenyl)-2-[(4-methyl-1,3-thiazol-3-ium-3-yl)methyl]benzamide bromide Traditional Name: N-(3-acetyl-2-myristyloxy-phenyl)-2-[(4-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=CC=C1NC(=O)C2=CC=CC=C2C[N+]3=CSC=C3C)C(=O)C.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=CC=C1NC(=O)C2=CC=CC=C2C[N+]3=CSC=C3C)C(=O)C.[Br-]

InChI

InChI=1S/C34H46N2O3S.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-17-23-39-33-30(28(3)37)21-18-22-32(33)35-34(38)31-20-16-15-19-29(31)24-36-26-40-25-27(36)2;/h15-16,18-22,25-26H,4-14,17,23-24H2,1-3H3;1H