3-(3-ethoxy-5-nitro-4-oxidanyl-phenyl)-2-(4-nitrophenyl)prop-2-enenitrile

Systemtic Name: 3-(3-ethoxy-5-nitro-4-oxidanyl-phenyl)-2-(4-nitrophenyl)prop-2-enenitrile Openeye Name: 3-(3-ethoxy-4-hydroxy-5-nitro-phenyl)-2-(4-nitrophenyl)prop-2-enenitrile CAS Name: 3-(3-ethoxy-4-hydroxy-5-nitrophenyl)-2-(4-nitrophenyl)-2-propenenitrile IUPAC Name: 3-(3-ethoxy-4-hydroxy-5-nitrophenyl)-2-(4-nitrophenyl)prop-2-enenitrile Traditional Name: 3-(3-ethoxy-4-hydroxy-5-nitro-phenyl)-2-(4-nitrophenyl)acrylonitrile Formula: C17H13N3O6 MolecularWeight: 355.30162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])C=C(C#N)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])C=C(C#N)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O6/c1-2-26-16-9-11(8-15(17(16)21)20(24)25)7-13(10-18)12-3-5-14(6-4-12)19(22)23/h3-9,21H,2H2,1H3