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

Systemtic Name: 3,4-dimethoxy-N-[2-(2-morpholin-4-ium-4-ylethylcarbamoyl)phenyl]benzamide Openeye Name: 3,4-dimethoxy-N-[2-(2-morpholin-4-ium-4-ylethylcarbamoyl)phenyl]benzamide CAS Name: 3,4-dimethoxy-N-[2-[[2-(4-morpholin-4-iumyl)ethylamino]-oxomethyl]phenyl]benzamide IUPAC Name: 3,4-dimethoxy-N-[2-(2-morpholin-4-ium-4-ylethylcarbamoyl)phenyl]benzamide Traditional Name: 3,4-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=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)NCC[NH+]3CCOCC3)OC

Isomeric SMILES

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

InChI

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