(3E)-3-[[[4-(azetidin-1-ylmethyl)phenyl]amino]-phenyl-methylidene]-5-nitro-1H-indol-2-one

Systemtic Name: (3E)-3-[[[4-(azetidin-1-ylmethyl)phenyl]amino]-phenyl-methylidene]-5-nitro-1H-indol-2-one Openeye Name: (3E)-3-[[4-(azetidin-1-ylmethyl)anilino]-phenyl-methylene]-5-nitro-indolin-2-one CAS Name: (3E)-3-[[4-(1-azetidinylmethyl)anilino]-phenylmethylidene]-5-nitro-1H-indol-2-one IUPAC Name: (3E)-3-[[4-(azetidin-1-ylmethyl)anilino]-phenylmethylidene]-5-nitro-1H-indol-2-one Traditional Name: (3E)-3-[[4-(azetidin-1-ylmethyl)anilino]-phenyl-methylene]-5-nitro-oxindole Formula: C25H22N4O3 MolecularWeight: 426.46718

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1)CC2=CC=C(C=C2)NC(=C3C4=C(C=CC(=C4)[N+](=O)[O-])NC3=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(C1)CC2=CC=C(C=C2)N/C(=C/3\C4=C(C=CC(=C4)[N+](=O)[O-])NC3=O)/C5=CC=CC=C5

InChI

InChI=1S/C25H22N4O3/c30-25-23(21-15-20(29(31)32)11-12-22(21)27-25)24(18-5-2-1-3-6-18)26-19-9-7-17(8-10-19)16-28-13-4-14-28/h1-3,5-12,15,26H,4,13-14,16H2,(H,27,30)/b24-23+