N-[(3-hexadecoxyphenyl)methyl]-N-[3-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]ethanamide

Systemtic Name: N-[(3-hexadecoxyphenyl)methyl]-N-[3-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]ethanamide Openeye Name: N-[(3-hexadecoxyphenyl)methyl]-N-[3-(thiazol-3-ium-3-ylmethyl)phenyl]acetamide CAS Name: N-[(3-hexadecoxyphenyl)methyl]-N-[3-(3-thiazol-3-iumylmethyl)phenyl]acetamide IUPAC Name: N-[(3-hexadecoxyphenyl)methyl]-N-[3-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]acetamide Traditional Name: N-(3-cetyloxybenzyl)-N-[3-(thiazol-3-ium-3-ylmethyl)phenyl]acetamide Formula: C35H51N2O2S+ MolecularWeight: 563.85664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC=CC(=C1)CN(C2=CC=CC(=C2)C[N+]3=CSC=C3)C(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC=CC(=C1)CN(C2=CC=CC(=C2)C[N+]3=CSC=C3)C(=O)C

InChI

InChI=1S/C35H51N2O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-24-39-35-22-18-20-33(27-35)29-37(31(2)38)34-21-17-19-32(26-34)28-36-23-25-40-30-36/h17-23,25-27,30H,3-16,24,28-29H2,1-2H3/q+1