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

Systemtic Name: 3-methoxy-4-tetradecoxy-N-[3-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]benzamide bromide Openeye Name: 3-methoxy-4-tetradecoxy-N-[3-(thiazol-3-ium-3-ylmethyl)phenyl]benzamide bromide CAS Name: 3-methoxy-4-tetradecoxy-N-[3-(3-thiazol-3-iumylmethyl)phenyl]benzamide bromide IUPAC Name: 3-methoxy-4-tetradecoxy-N-[3-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]benzamide bromide Traditional Name: 3-methoxy-4-myristyloxy-N-[3-(thiazol-3-ium-3-ylmethyl)phenyl]benzamide bromide Formula: C32H45BrN2O3S MolecularWeight: 617.6803

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C[N+]3=CSC=C3)OC.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C[N+]3=CSC=C3)OC.[Br-]

InChI

InChI=1S/C32H44N2O3S.BrH/c1-3-4-5-6-7-8-9-10-11-12-13-14-21-37-30-19-18-28(24-31(30)36-2)32(35)33-29-17-15-16-27(23-29)25-34-20-22-38-26-34;/h15-20,22-24,26H,3-14,21,25H2,1-2H3;1H