1-(4-chlorophenyl)-5-(furan-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-3-carboxamide

Systemtic Name: 1-(4-chlorophenyl)-5-(furan-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-3-carboxamide Openeye Name: 1-(4-chlorophenyl)-5-(2-furyl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-3-carboxamide CAS Name: 1-(4-chlorophenyl)-5-(2-furanyl)-N-[2-(4-morpholin-4-iumyl)ethyl]-3-pyrazolecarboxamide IUPAC Name: 1-(4-chlorophenyl)-5-(furan-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-3-carboxamide Traditional Name: 1-(4-chlorophenyl)-5-(2-furyl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-3-carboxamide Formula: C20H22ClN4O3+ MolecularWeight: 401.86668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)C2=NN(C(=C2)C3=CC=CO3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)C2=NN(C(=C2)C3=CC=CO3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H21ClN4O3/c21-15-3-5-16(6-4-15)25-18(19-2-1-11-28-19)14-17(23-25)20(26)22-7-8-24-9-12-27-13-10-24/h1-6,11,14H,7-10,12-13H2,(H,22,26)/p+1