4-[2-(4-chlorophenyl)ethanoyl]-N-(3-morpholin-4-ium-4-ylpropyl)-1H-pyrrole-2-carboxamide

Systemtic Name: 4-[2-(4-chlorophenyl)ethanoyl]-N-(3-morpholin-4-ium-4-ylpropyl)-1H-pyrrole-2-carboxamide Openeye Name: 4-[2-(4-chlorophenyl)acetyl]-N-(3-morpholin-4-ium-4-ylpropyl)-1H-pyrrole-2-carboxamide CAS Name: 4-[2-(4-chlorophenyl)-1-oxoethyl]-N-[3-(4-morpholin-4-iumyl)propyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-[2-(4-chlorophenyl)acetyl]-N-(3-morpholin-4-ium-4-ylpropyl)-1H-pyrrole-2-carboxamide Traditional Name: 4-[2-(4-chlorophenyl)acetyl]-N-(3-morpholin-4-ium-4-ylpropyl)-1H-pyrrole-2-carboxamide Formula: C20H25ClN3O3+ MolecularWeight: 390.8838

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C2=CC(=CN2)C(=O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C2=CC(=CN2)C(=O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H24ClN3O3/c21-17-4-2-15(3-5-17)12-19(25)16-13-18(23-14-16)20(26)22-6-1-7-24-8-10-27-11-9-24/h2-5,13-14,23H,1,6-12H2,(H,22,26)/p+1