4-nitro-2-[(3,4,5-trimethoxyphenyl)methyliminomethyl]phenolate

Systemtic Name: 4-nitro-2-[(3,4,5-trimethoxyphenyl)methyliminomethyl]phenolate Openeye Name: 4-nitro-2-[(3,4,5-trimethoxyphenyl)methyliminomethyl]phenolate CAS Name: 4-nitro-2-[(3,4,5-trimethoxyphenyl)methyliminomethyl]phenolate IUPAC Name: 4-nitro-2-[(3,4,5-trimethoxyphenyl)methyliminomethyl]phenolate Traditional Name: 4-nitro-2-[(3,4,5-trimethoxybenzyl)iminomethyl]phenolate Formula: C17H17N2O6- MolecularWeight: 345.32668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CN=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CN=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C17H18N2O6/c1-23-15-6-11(7-16(24-2)17(15)25-3)9-18-10-12-8-13(19(21)22)4-5-14(12)20/h4-8,10,20H,9H2,1-3H3/p-1