1-[[4-[[(E)-(5-nitro-2-oxidanylidene-1H-indol-3-ylidene)-phenyl-methyl]amino]phenyl]methyl]piperidine-4-carboxamide

Systemtic Name: 1-[[4-[[(E)-(5-nitro-2-oxidanylidene-1H-indol-3-ylidene)-phenyl-methyl]amino]phenyl]methyl]piperidine-4-carboxamide Openeye Name: 1-[[4-[[(E)-(5-nitro-2-oxo-indolin-3-ylidene)-phenyl-methyl]amino]phenyl]methyl]piperidine-4-carboxamide CAS Name: 1-[[4-[[(E)-(5-nitro-2-oxo-1H-indol-3-ylidene)-phenylmethyl]amino]phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-[[4-[[(E)-(5-nitro-2-oxo-1H-indol-3-ylidene)-phenylmethyl]amino]phenyl]methyl]piperidine-4-carboxamide Traditional Name: 1-[4-[[(E)-(2-keto-5-nitro-indolin-3-ylidene)-phenyl-methyl]amino]benzyl]isonipecotamide Formula: C28H27N5O4 MolecularWeight: 497.54508

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)CC2=CC=C(C=C2)NC(=C3C4=C(C=CC(=C4)[N+](=O)[O-])NC3=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)N)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/C28H27N5O4/c29-27(34)20-12-14-32(15-13-20)17-18-6-8-21(9-7-18)30-26(19-4-2-1-3-5-19)25-23-16-22(33(36)37)10-11-24(23)31-28(25)35/h1-11,16,20,30H,12-15,17H2,(H2,29,34)(H,31,35)/b26-25+