N-(2-tetradecoxyphenyl)-4-(1,3-thiazol-3-ium-3-ylmethyl)benzamide

Systemtic Name: N-(2-tetradecoxyphenyl)-4-(1,3-thiazol-3-ium-3-ylmethyl)benzamide Openeye Name: N-(2-tetradecoxyphenyl)-4-(thiazol-3-ium-3-ylmethyl)benzamide CAS Name: N-(2-tetradecoxyphenyl)-4-(3-thiazol-3-iumylmethyl)benzamide IUPAC Name: N-(2-tetradecoxyphenyl)-4-(1,3-thiazol-3-ium-3-ylmethyl)benzamide Traditional Name: N-(2-myristyloxyphenyl)-4-(thiazol-3-ium-3-ylmethyl)benzamide Formula: C31H43N2O2S+ MolecularWeight: 507.75032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)C[N+]3=CSC=C3

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)C[N+]3=CSC=C3

InChI

InChI=1S/C31H42N2O2S/c1-2-3-4-5-6-7-8-9-10-11-12-15-23-35-30-17-14-13-16-29(30)32-31(34)28-20-18-27(19-21-28)25-33-22-24-36-26-33/h13-14,16-22,24,26H,2-12,15,23,25H2,1H3/p+1