2-(3,5-dimethylphenoxy)-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]ethanamide

Systemtic Name: 2-(3,5-dimethylphenoxy)-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]ethanamide Openeye Name: 2-(3,5-dimethylphenoxy)-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]acetamide CAS Name: 2-(3,5-dimethylphenoxy)-N-[4-(4-morpholin-4-iumylmethyl)phenyl]acetamide IUPAC Name: 2-(3,5-dimethylphenoxy)-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]acetamide Traditional Name: 2-(3,5-dimethylphenoxy)-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]acetamide Formula: C21H27N2O3+ MolecularWeight: 355.45068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)NC2=CC=C(C=C2)C[NH+]3CCOCC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)NC2=CC=C(C=C2)C[NH+]3CCOCC3)C

InChI

InChI=1S/C21H26N2O3/c1-16-11-17(2)13-20(12-16)26-15-21(24)22-19-5-3-18(4-6-19)14-23-7-9-25-10-8-23/h3-6,11-13H,7-10,14-15H2,1-2H3,(H,22,24)/p+1