N-[(4-methoxy-3-tetradecoxy-phenyl)methyl]-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]ethanamide bromide

Systemtic Name: N-[(4-methoxy-3-tetradecoxy-phenyl)methyl]-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]ethanamide bromide Openeye Name: N-[(4-methoxy-3-tetradecoxy-phenyl)methyl]-N-[4-(thiazol-3-ium-3-ylmethyl)phenyl]acetamide bromide CAS Name: N-[(4-methoxy-3-tetradecoxyphenyl)methyl]-N-[4-(3-thiazol-3-iumylmethyl)phenyl]acetamide bromide IUPAC Name: N-[(4-methoxy-3-tetradecoxyphenyl)methyl]-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]acetamide bromide Traditional Name: N-(4-methoxy-3-myristyloxy-benzyl)-N-[4-(thiazol-3-ium-3-ylmethyl)phenyl]acetamide bromide Formula: C34H49BrN2O3S MolecularWeight: 645.73346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H49N2O3S.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-23-39-34-25-31(18-21-33(34)38-3)27-36(29(2)37)32-19-16-30(17-20-32)26-35-22-24-40-28-35;/h16-22,24-25,28H,4-15,23,26-27H2,1-3H3;1H/q+1;/p-1