2-nitro-4-(phenylmethyl)-6-[(2-piperidin-1-ylphenyl)iminomethyl]phenolate

Systemtic Name: 2-nitro-4-(phenylmethyl)-6-[(2-piperidin-1-ylphenyl)iminomethyl]phenolate Openeye Name: 4-benzyl-2-nitro-6-[[2-(1-piperidyl)phenyl]iminomethyl]phenolate CAS Name: 2-nitro-4-(phenylmethyl)-6-[[2-(1-piperidinyl)phenyl]iminomethyl]phenolate IUPAC Name: 4-benzyl-2-nitro-6-[(2-piperidin-1-ylphenyl)iminomethyl]phenolate Traditional Name: 4-benzyl-2-nitro-6-[(2-piperidinophenyl)iminomethyl]phenolate Formula: C25H24N3O3- MolecularWeight: 414.47636

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=CC=C2N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])CC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=CC=CC=C2N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])CC4=CC=CC=C4

InChI

InChI=1S/C25H25N3O3/c29-25-21(16-20(17-24(25)28(30)31)15-19-9-3-1-4-10-19)18-26-22-11-5-6-12-23(22)27-13-7-2-8-14-27/h1,3-6,9-12,16-18,29H,2,7-8,13-15H2/p-1