1-(4-chlorophenyl)-2-[4-(3-phenylprop-2-ynyl)morpholin-4-ium-4-yl]ethanone

Systemtic Name: 1-(4-chlorophenyl)-2-[4-(3-phenylprop-2-ynyl)morpholin-4-ium-4-yl]ethanone Openeye Name: 1-(4-chlorophenyl)-2-[4-(3-phenylprop-2-ynyl)morpholin-4-ium-4-yl]ethanone CAS Name: 1-(4-chlorophenyl)-2-[4-(3-phenylprop-2-ynyl)-4-morpholin-4-iumyl]ethanone IUPAC Name: 1-(4-chlorophenyl)-2-[4-(3-phenylprop-2-ynyl)morpholin-4-ium-4-yl]ethanone Traditional Name: 1-(4-chlorophenyl)-2-[4-(3-phenylprop-2-ynyl)morpholin-4-ium-4-yl]ethanone Formula: C21H21ClNO2+ MolecularWeight: 354.84994

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[N+]1(CC#CC2=CC=CC=C2)CC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1COCC[N+]1(CC#CC2=CC=CC=C2)CC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H21ClNO2/c22-20-10-8-19(9-11-20)21(24)17-23(13-15-25-16-14-23)12-4-7-18-5-2-1-3-6-18/h1-3,5-6,8-11H,12-17H2/q+1