2-[2-(3,4-dimethoxyphenyl)ethyliminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethyliminomethyl]-4-nitro-phenolate Openeye Name: 2-[2-(3,4-dimethoxyphenyl)ethyliminomethyl]-4-nitro-phenolate CAS Name: 2-[2-(3,4-dimethoxyphenyl)ethyliminomethyl]-4-nitrophenolate IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)ethyliminomethyl]-4-nitrophenolate Traditional Name: 2-(homoveratryliminomethyl)-4-nitro-phenolate Formula: C17H17N2O5- MolecularWeight: 329.32728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])OC

InChI

InChI=1S/C17H18N2O5/c1-23-16-6-3-12(9-17(16)24-2)7-8-18-11-13-10-14(19(21)22)4-5-15(13)20/h3-6,9-11,20H,7-8H2,1-2H3/p-1