2-[2-[4-(2-chlorophenyl)morpholin-4-ium-4-yl]-2-cyano-ethyl]benzoic acid

Systemtic Name: 2-[2-[4-(2-chlorophenyl)morpholin-4-ium-4-yl]-2-cyano-ethyl]benzoic acid Openeye Name: 2-[2-[4-(2-chlorophenyl)morpholin-4-ium-4-yl]-2-cyano-ethyl]benzoic acid CAS Name: 2-[2-[4-(2-chlorophenyl)-4-morpholin-4-iumyl]-2-cyanoethyl]benzoic acid IUPAC Name: 2-[2-[4-(2-chlorophenyl)morpholin-4-ium-4-yl]-2-cyanoethyl]benzoic acid Traditional Name: 2-[2-[4-(2-chlorophenyl)morpholin-4-ium-4-yl]-2-cyano-ethyl]benzoic acid Formula: C20H20ClN2O3+ MolecularWeight: 371.8374

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[N+]1(C2=CC=CC=C2Cl)C(CC3=CC=CC=C3C(=O)O)C#N

Isomeric SMILES

C1COCC[N+]1(C2=CC=CC=C2Cl)C(CC3=CC=CC=C3C(=O)O)C#N

InChI

InChI=1S/C20H19ClN2O3/c21-18-7-3-4-8-19(18)23(9-11-26-12-10-23)16(14-22)13-15-5-1-2-6-17(15)20(24)25/h1-8,16H,9-13H2/p+1