2-[(3-methoxy-4-phenylmethoxy-phenyl)methyl-methyl-amino]-5-nitro-pyridine-3-carbonitrile

Systemtic Name: 2-[(3-methoxy-4-phenylmethoxy-phenyl)methyl-methyl-amino]-5-nitro-pyridine-3-carbonitrile Openeye Name: 2-[(4-benzyloxy-3-methoxy-phenyl)methyl-methyl-amino]-5-nitro-pyridine-3-carbonitrile CAS Name: 2-[(3-methoxy-4-phenylmethoxyphenyl)methyl-methylamino]-5-nitro-3-pyridinecarbonitrile IUPAC Name: 2-[(3-methoxy-4-phenylmethoxyphenyl)methyl-methylamino]-5-nitropyridine-3-carbonitrile Traditional Name: 2-[(4-benzoxy-3-methoxy-benzyl)-methyl-amino]-5-nitro-nicotinonitrile Formula: C22H20N4O4 MolecularWeight: 404.4186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)C3=NC=C(C=C3C#N)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)C3=NC=C(C=C3C#N)[N+](=O)[O-]

InChI

InChI=1S/C22H20N4O4/c1-25(22-18(12-23)11-19(13-24-22)26(27)28)14-17-8-9-20(21(10-17)29-2)30-15-16-6-4-3-5-7-16/h3-11,13H,14-15H2,1-2H3