2-[4-(6-chloranyl-4-oxidanylidene-chromen-2-yl)carbonylpiperazin-1-ium-1-yl]-N-cyclopropyl-ethanamide

Systemtic Name: 2-[4-(6-chloranyl-4-oxidanylidene-chromen-2-yl)carbonylpiperazin-1-ium-1-yl]-N-cyclopropyl-ethanamide Openeye Name: 2-[4-(6-chloro-4-oxo-chromene-2-carbonyl)piperazin-1-ium-1-yl]-N-cyclopropyl-acetamide CAS Name: 2-[4-[(6-chloro-4-oxo-1-benzopyran-2-yl)-oxomethyl]-1-piperazin-1-iumyl]-N-cyclopropylacetamide IUPAC Name: 2-[4-(6-chloro-4-oxochromene-2-carbonyl)piperazin-1-ium-1-yl]-N-cyclopropylacetamide Traditional Name: 2-[4-(6-chloro-4-keto-chromene-2-carbonyl)piperazin-1-ium-1-yl]-N-cyclopropyl-acetamide Formula: C19H21ClN3O4+ MolecularWeight: 390.84074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1CC1NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C19H20ClN3O4/c20-12-1-4-16-14(9-12)15(24)10-17(27-16)19(26)23-7-5-22(6-8-23)11-18(25)21-13-2-3-13/h1,4,9-10,13H,2-3,5-8,11H2,(H,21,25)/p+1