3-[3-methoxy-4-(5-nitropyridin-2-yl)oxy-phenyl]-2-phenyl-prop-2-enenitrile

Systemtic Name: 3-[3-methoxy-4-(5-nitropyridin-2-yl)oxy-phenyl]-2-phenyl-prop-2-enenitrile Openeye Name: 3-[3-methoxy-4-[(5-nitro-2-pyridyl)oxy]phenyl]-2-phenyl-prop-2-enenitrile CAS Name: 3-[3-methoxy-4-[(5-nitro-2-pyridinyl)oxy]phenyl]-2-phenyl-2-propenenitrile IUPAC Name: 3-[3-methoxy-4-(5-nitropyridin-2-yl)oxyphenyl]-2-phenylprop-2-enenitrile Traditional Name: 3-[3-methoxy-4-[(5-nitro-2-pyridyl)oxy]phenyl]-2-phenyl-acrylonitrile Formula: C21H15N3O4 MolecularWeight: 373.3615

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C2=CC=CC=C2)OC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C=C(C#N)C2=CC=CC=C2)OC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O4/c1-27-20-12-15(11-17(13-22)16-5-3-2-4-6-16)7-9-19(20)28-21-10-8-18(14-23-21)24(25)26/h2-12,14H,1H3