N-[2-(3-dodecoxyphenyl)ethyl]-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]ethanamide

Systemtic Name: N-[2-(3-dodecoxyphenyl)ethyl]-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]ethanamide Openeye Name: N-[2-(3-dodecoxyphenyl)ethyl]-N-[4-(thiazol-3-ium-3-ylmethyl)phenyl]acetamide CAS Name: N-[2-(3-dodecoxyphenyl)ethyl]-N-[4-(3-thiazol-3-iumylmethyl)phenyl]acetamide IUPAC Name: N-[2-(3-dodecoxyphenyl)ethyl]-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]acetamide Traditional Name: N-[2-(3-lauryloxyphenyl)ethyl]-N-[4-(thiazol-3-ium-3-ylmethyl)phenyl]acetamide Formula: C32H45N2O2S+ MolecularWeight: 521.7769

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=CC(=C1)CCN(C2=CC=C(C=C2)C[N+]3=CSC=C3)C(=O)C

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=CC(=C1)CCN(C2=CC=C(C=C2)C[N+]3=CSC=C3)C(=O)C

InChI

InChI=1S/C32H45N2O2S/c1-3-4-5-6-7-8-9-10-11-12-23-36-32-15-13-14-29(25-32)20-21-34(28(2)35)31-18-16-30(17-19-31)26-33-22-24-37-27-33/h13-19,22,24-25,27H,3-12,20-21,23,26H2,1-2H3/q+1