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

Systemtic Name: 3,4-dimethoxy-N-[2-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]benzamide Openeye Name: 3,4-dimethoxy-N-[2-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]benzamide CAS Name: 3,4-dimethoxy-N-[2-[[3-(4-morpholin-4-iumyl)propylamino]-oxomethyl]phenyl]benzamide IUPAC Name: 3,4-dimethoxy-N-[2-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]benzamide Traditional Name: 3,4-dimethoxy-N-[2-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]benzamide Formula: C23H30N3O5+ MolecularWeight: 428.5014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O5/c1-29-20-9-8-17(16-21(20)30-2)22(27)25-19-7-4-3-6-18(19)23(28)24-10-5-11-26-12-14-31-15-13-26/h3-4,6-9,16H,5,10-15H2,1-2H3,(H,24,28)(H,25,27)/p+1