3,5-dimethoxy-N-[2-(2-morpholin-4-ium-4-ylethylcarbamoyl)phenyl]benzamide

Systemtic Name: 3,5-dimethoxy-N-[2-(2-morpholin-4-ium-4-ylethylcarbamoyl)phenyl]benzamide Openeye Name: 3,5-dimethoxy-N-[2-(2-morpholin-4-ium-4-ylethylcarbamoyl)phenyl]benzamide CAS Name: 3,5-dimethoxy-N-[2-[[2-(4-morpholin-4-iumyl)ethylamino]-oxomethyl]phenyl]benzamide IUPAC Name: 3,5-dimethoxy-N-[2-(2-morpholin-4-ium-4-ylethylcarbamoyl)phenyl]benzamide Traditional Name: 3,5-dimethoxy-N-[2-(2-morpholin-4-ium-4-ylethylcarbamoyl)phenyl]benzamide Formula: C22H28N3O5+ MolecularWeight: 414.47482

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NC2=CC=CC=C2C(=O)NCC[NH+]3CCOCC3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NC2=CC=CC=C2C(=O)NCC[NH+]3CCOCC3)OC

InChI

InChI=1S/C22H27N3O5/c1-28-17-13-16(14-18(15-17)29-2)21(26)24-20-6-4-3-5-19(20)22(27)23-7-8-25-9-11-30-12-10-25/h3-6,13-15H,7-12H2,1-2H3,(H,23,27)(H,24,26)/p+1