3-chloranyl-4-tetradecoxy-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]benzamide

Systemtic Name: 3-chloranyl-4-tetradecoxy-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]benzamide Openeye Name: 3-chloro-4-tetradecoxy-N-[4-(thiazol-3-ium-3-ylmethyl)phenyl]benzamide CAS Name: 3-chloro-4-tetradecoxy-N-[4-(3-thiazol-3-iumylmethyl)phenyl]benzamide IUPAC Name: 3-chloro-4-tetradecoxy-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]benzamide Traditional Name: 3-chloro-4-myristyloxy-N-[4-(thiazol-3-ium-3-ylmethyl)phenyl]benzamide Formula: C31H42ClN2O2S+ MolecularWeight: 542.19538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C[N+]3=CSC=C3)Cl

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C[N+]3=CSC=C3)Cl

InChI

InChI=1S/C31H41ClN2O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-21-36-30-19-16-27(23-29(30)32)31(35)33-28-17-14-26(15-18-28)24-34-20-22-37-25-34/h14-20,22-23,25H,2-13,21,24H2,1H3/p+1