3-(3,4-dimethoxyphenyl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 3-(3,4-dimethoxyphenyl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]propanamide Openeye Name: 3-(3,4-dimethoxyphenyl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]propanamide CAS Name: 3-(3,4-dimethoxyphenyl)-N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]propanamide IUPAC Name: 3-(3,4-dimethoxyphenyl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]propanamide Traditional Name: 3-(3,4-dimethoxyphenyl)-N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]propionamide Formula: C23H31N2O4+ MolecularWeight: 399.50324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)NCC2=CC=CC=C2C[NH+]3CCOCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)NCC2=CC=CC=C2C[NH+]3CCOCC3)OC

InChI

InChI=1S/C23H30N2O4/c1-27-21-9-7-18(15-22(21)28-2)8-10-23(26)24-16-19-5-3-4-6-20(19)17-25-11-13-29-14-12-25/h3-7,9,15H,8,10-14,16-17H2,1-2H3,(H,24,26)/p+1