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

Systemtic Name: (3E)-5-nitro-3-[phenyl-[[4-(piperazin-1-ylmethyl)phenyl]amino]methylidene]-1H-indol-2-one Openeye Name: (3E)-5-nitro-3-[phenyl-[4-(piperazin-1-ylmethyl)anilino]methylene]indolin-2-one CAS Name: (3E)-5-nitro-3-[phenyl-[4-(1-piperazinylmethyl)anilino]methylidene]-1H-indol-2-one IUPAC Name: (3E)-5-nitro-3-[phenyl-[4-(piperazin-1-ylmethyl)anilino]methylidene]-1H-indol-2-one Traditional Name: (3E)-5-nitro-3-[phenyl-[4-(piperazinomethyl)anilino]methylene]oxindole Formula: C26H25N5O3 MolecularWeight: 455.5084

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC2=CC=C(C=C2)NC(=C3C4=C(C=CC(=C4)[N+](=O)[O-])NC3=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1)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/C26H25N5O3/c32-26-24(22-16-21(31(33)34)10-11-23(22)29-26)25(19-4-2-1-3-5-19)28-20-8-6-18(7-9-20)17-30-14-12-27-13-15-30/h1-11,16,27-28H,12-15,17H2,(H,29,32)/b25-24+