N-[(2R)-2-(4-dimethylaminophenyl)-2-morpholin-4-ium-4-yl-ethyl]-3-phenyl-propanamide

Systemtic Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-morpholin-4-ium-4-yl-ethyl]-3-phenyl-propanamide Openeye Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-morpholin-4-ium-4-yl-ethyl]-3-phenyl-propanamide CAS Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-morpholin-4-iumyl)ethyl]-3-phenylpropanamide IUPAC Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-morpholin-4-ium-4-ylethyl]-3-phenylpropanamide Traditional Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-morpholin-4-ium-4-yl-ethyl]-3-phenyl-propionamide Formula: C23H32N3O2+ MolecularWeight: 382.51908

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNC(=O)CCC2=CC=CC=C2)[NH+]3CCOCC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)[C@H](CNC(=O)CCC2=CC=CC=C2)[NH+]3CCOCC3

InChI

InChI=1S/C23H31N3O2/c1-25(2)21-11-9-20(10-12-21)22(26-14-16-28-17-15-26)18-24-23(27)13-8-19-6-4-3-5-7-19/h3-7,9-12,22H,8,13-18H2,1-2H3,(H,24,27)/p+1/t22-/m0/s1