N-(3-ethanoyl-2-tetradecoxy-phenyl)-4-(1,3-thiazol-3-ium-3-ylmethyl)benzamide

Systemtic Name: N-(3-ethanoyl-2-tetradecoxy-phenyl)-4-(1,3-thiazol-3-ium-3-ylmethyl)benzamide Openeye Name: N-(3-acetyl-2-tetradecoxy-phenyl)-4-(thiazol-3-ium-3-ylmethyl)benzamide CAS Name: N-(3-acetyl-2-tetradecoxyphenyl)-4-(3-thiazol-3-iumylmethyl)benzamide IUPAC Name: N-(3-acetyl-2-tetradecoxyphenyl)-4-(1,3-thiazol-3-ium-3-ylmethyl)benzamide Traditional Name: N-(3-acetyl-2-myristyloxy-phenyl)-4-(thiazol-3-ium-3-ylmethyl)benzamide Formula: C33H45N2O3S+ MolecularWeight: 549.787

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H44N2O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-23-38-32-30(27(2)36)16-15-17-31(32)34-33(37)29-20-18-28(19-21-29)25-35-22-24-39-26-35/h15-22,24,26H,3-14,23,25H2,1-2H3/p+1