2-(1,2-dihydroacenaphthylen-5-yliminomethyl)-6-nitro-4-(phenylmethyl)phenolate

Systemtic Name: 2-(1,2-dihydroacenaphthylen-5-yliminomethyl)-6-nitro-4-(phenylmethyl)phenolate Openeye Name: 4-benzyl-2-(1,2-dihydroacenaphthylen-5-yliminomethyl)-6-nitro-phenolate CAS Name: 2-(1,2-dihydroacenaphthylen-5-yliminomethyl)-6-nitro-4-(phenylmethyl)phenolate IUPAC Name: 4-benzyl-2-(1,2-dihydroacenaphthylen-5-yliminomethyl)-6-nitrophenolate Traditional Name: 2-(acenaphthen-5-yliminomethyl)-4-benzyl-6-nitro-phenolate Formula: C26H19N2O3- MolecularWeight: 407.44066

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC3=C(C=CC1=C23)N=CC4=CC(=CC(=C4[O-])[N+](=O)[O-])CC5=CC=CC=C5

Isomeric SMILES

C1CC2=CC=CC3=C(C=CC1=C23)N=CC4=CC(=CC(=C4[O-])[N+](=O)[O-])CC5=CC=CC=C5

InChI

InChI=1S/C26H20N2O3/c29-26-21(14-18(15-24(26)28(30)31)13-17-5-2-1-3-6-17)16-27-23-12-11-20-10-9-19-7-4-8-22(23)25(19)20/h1-8,11-12,14-16,29H,9-10,13H2/p-1