2-(3-ethanoyl-2-tetradecoxy-phenyl)-N-[3-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]ethanamide bromide

Systemtic Name: 2-(3-ethanoyl-2-tetradecoxy-phenyl)-N-[3-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]ethanamide bromide Openeye Name: 2-(3-acetyl-2-tetradecoxy-phenyl)-N-[3-(thiazol-3-ium-3-ylmethyl)phenyl]acetamide bromide CAS Name: 2-(3-acetyl-2-tetradecoxyphenyl)-N-[3-(3-thiazol-3-iumylmethyl)phenyl]acetamide bromide IUPAC Name: 2-(3-acetyl-2-tetradecoxyphenyl)-N-[3-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]acetamide bromide Traditional Name: 2-(3-acetyl-2-myristyloxy-phenyl)-N-[3-(thiazol-3-ium-3-ylmethyl)phenyl]acetamide bromide Formula: C34H47BrN2O3S MolecularWeight: 643.71758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=CC=C1CC(=O)NC2=CC=CC(=C2)C[N+]3=CSC=C3)C(=O)C.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=CC=C1CC(=O)NC2=CC=CC(=C2)C[N+]3=CSC=C3)C(=O)C.[Br-]

InChI

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