3-chloranyl-4,5-dimethoxy-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]benzamide

Systemtic Name: 3-chloranyl-4,5-dimethoxy-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]benzamide Openeye Name: 3-chloro-4,5-dimethoxy-N-[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]benzamide CAS Name: 3-chloro-4,5-dimethoxy-N-[(1R)-1-(4-methylphenyl)-2-(4-morpholin-4-iumyl)ethyl]benzamide IUPAC Name: 3-chloro-4,5-dimethoxy-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-ylethyl]benzamide Traditional Name: 3-chloro-4,5-dimethoxy-N-[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]benzamide Formula: C22H28ClN2O4+ MolecularWeight: 419.92172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C[NH+]2CCOCC2)NC(=O)C3=CC(=C(C(=C3)Cl)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C[NH+]2CCOCC2)NC(=O)C3=CC(=C(C(=C3)Cl)OC)OC

InChI

InChI=1S/C22H27ClN2O4/c1-15-4-6-16(7-5-15)19(14-25-8-10-29-11-9-25)24-22(26)17-12-18(23)21(28-3)20(13-17)27-2/h4-7,12-13,19H,8-11,14H2,1-3H3,(H,24,26)/p+1/t19-/m0/s1