6-bromanyl-3-[(5R)-5-(4-bromophenyl)-1-(2-piperidin-1-ium-1-ylethanoyl)pyrazolidin-3-ylidene]-4-phenyl-quinolin-2-one

Systemtic Name: 6-bromanyl-3-[(5R)-5-(4-bromophenyl)-1-(2-piperidin-1-ium-1-ylethanoyl)pyrazolidin-3-ylidene]-4-phenyl-quinolin-2-one Openeye Name: 6-bromo-3-[(5R)-5-(4-bromophenyl)-1-(2-piperidin-1-ium-1-ylacetyl)pyrazolidin-3-ylidene]-4-phenyl-quinolin-2-one CAS Name: 6-bromo-3-[(5R)-5-(4-bromophenyl)-1-[1-oxo-2-(1-piperidin-1-iumyl)ethyl]-3-pyrazolidinylidene]-4-phenyl-2-quinolinone IUPAC Name: 6-bromo-3-[(5R)-5-(4-bromophenyl)-1-(2-piperidin-1-ium-1-ylacetyl)pyrazolidin-3-ylidene]-4-phenylquinolin-2-one Traditional Name: 6-bromo-3-[(5R)-5-(4-bromophenyl)-1-(2-piperidin-1-ium-1-ylacetyl)pyrazolidin-3-ylidene]-4-phenyl-carbostyril Formula: C31H29Br2N4O2+ MolecularWeight: 649.39556

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=O)N2C(CC(=C3C(=C4C=C(C=CC4=NC3=O)Br)C5=CC=CC=C5)N2)C6=CC=C(C=C6)Br

Isomeric SMILES

C1CC[NH+](CC1)CC(=O)N2[C@H](CC(=C3C(=C4C=C(C=CC4=NC3=O)Br)C5=CC=CC=C5)N2)C6=CC=C(C=C6)Br

InChI

InChI=1S/C31H28Br2N4O2/c32-22-11-9-20(10-12-22)27-18-26(35-37(27)28(38)19-36-15-5-2-6-16-36)30-29(21-7-3-1-4-8-21)24-17-23(33)13-14-25(24)34-31(30)39/h1,3-4,7-14,17,27,35H,2,5-6,15-16,18-19H2/p+1/t27-/m1/s1