6-chloranyl-3-[(5S)-5-(furan-2-yl)-1-(2-morpholin-4-ium-4-ylethanoyl)pyrazolidin-3-ylidene]-4-phenyl-quinolin-2-one

Systemtic Name: 6-chloranyl-3-[(5S)-5-(furan-2-yl)-1-(2-morpholin-4-ium-4-ylethanoyl)pyrazolidin-3-ylidene]-4-phenyl-quinolin-2-one Openeye Name: 6-chloro-3-[(5S)-5-(2-furyl)-1-(2-morpholin-4-ium-4-ylacetyl)pyrazolidin-3-ylidene]-4-phenyl-quinolin-2-one CAS Name: 6-chloro-3-[(5S)-5-(2-furanyl)-1-[2-(4-morpholin-4-iumyl)-1-oxoethyl]-3-pyrazolidinylidene]-4-phenyl-2-quinolinone IUPAC Name: 6-chloro-3-[(5S)-5-(furan-2-yl)-1-(2-morpholin-4-ium-4-ylacetyl)pyrazolidin-3-ylidene]-4-phenylquinolin-2-one Traditional Name: 6-chloro-3-[(5S)-5-(2-furyl)-1-(2-morpholin-4-ium-4-ylacetyl)pyrazolidin-3-ylidene]-4-phenyl-carbostyril Formula: C28H26ClN4O4+ MolecularWeight: 517.98344

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(=O)N2C(CC(=C3C(=C4C=C(C=CC4=NC3=O)Cl)C5=CC=CC=C5)N2)C6=CC=CO6

Isomeric SMILES

C1COCC[NH+]1CC(=O)N2[C@@H](CC(=C3C(=C4C=C(C=CC4=NC3=O)Cl)C5=CC=CC=C5)N2)C6=CC=CO6

InChI

InChI=1S/C28H25ClN4O4/c29-19-8-9-21-20(15-19)26(18-5-2-1-3-6-18)27(28(35)30-21)22-16-23(24-7-4-12-37-24)33(31-22)25(34)17-32-10-13-36-14-11-32/h1-9,12,15,23,31H,10-11,13-14,16-17H2/p+1/t23-/m0/s1