5-bromanyl-3-[[(2S)-4-oxidanyl-5-oxidanylidene-2-phenyl-2H-pyrrol-1-yl]amino]indol-2-one

Systemtic Name: 5-bromanyl-3-[[(2S)-4-oxidanyl-5-oxidanylidene-2-phenyl-2H-pyrrol-1-yl]amino]indol-2-one Openeye Name: 5-bromo-3-[[(2S)-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]amino]indol-2-one CAS Name: 5-bromo-3-[[(2S)-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]amino]-2-indolone IUPAC Name: 5-bromo-3-[[(2S)-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]amino]indol-2-one Traditional Name: 5-bromo-3-[[(5S)-3-hydroxy-2-keto-5-phenyl-3-pyrrolin-1-yl]amino]indol-2-one Formula: C18H12BrN3O3 MolecularWeight: 398.21018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C=C(C(=O)N2NC3=C4C=C(C=CC4=NC3=O)Br)O

Isomeric SMILES

C1=CC=C(C=C1)[C@@H]2C=C(C(=O)N2NC3=C4C=C(C=CC4=NC3=O)Br)O

InChI

InChI=1S/C18H12BrN3O3/c19-11-6-7-13-12(8-11)16(17(24)20-13)21-22-14(9-15(23)18(22)25)10-4-2-1-3-5-10/h1-9,14,23H,(H,20,21,24)/t14-/m0/s1