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

Systemtic Name: 3-(3-bromanyl-5-nitro-4-oxidanyl-phenyl)-2-(3-nitrophenyl)prop-2-enenitrile Openeye Name: 3-(3-bromo-4-hydroxy-5-nitro-phenyl)-2-(3-nitrophenyl)prop-2-enenitrile CAS Name: 3-(3-bromo-4-hydroxy-5-nitrophenyl)-2-(3-nitrophenyl)-2-propenenitrile IUPAC Name: 3-(3-bromo-4-hydroxy-5-nitrophenyl)-2-(3-nitrophenyl)prop-2-enenitrile Traditional Name: 3-(3-bromo-4-hydroxy-5-nitro-phenyl)-2-(3-nitrophenyl)acrylonitrile Formula: C15H8BrN3O5 MolecularWeight: 390.14512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=CC2=CC(=C(C(=C2)Br)O)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=CC2=CC(=C(C(=C2)Br)O)[N+](=O)[O-])C#N

InChI

InChI=1S/C15H8BrN3O5/c16-13-5-9(6-14(15(13)20)19(23)24)4-11(8-17)10-2-1-3-12(7-10)18(21)22/h1-7,20H