2-(1,3-benzodioxol-5-yl)-6-bromanyl-8-methoxy-3-nitro-2H-chromene

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-6-bromanyl-8-methoxy-3-nitro-2H-chromene Openeye Name: 2-(1,3-benzodioxol-5-yl)-6-bromo-8-methoxy-3-nitro-2H-chromene CAS Name: 2-(1,3-benzodioxol-5-yl)-6-bromo-8-methoxy-3-nitro-2H-1-benzopyran IUPAC Name: 2-(1,3-benzodioxol-5-yl)-6-bromo-8-methoxy-3-nitro-2H-chromene Traditional Name: 2-(1,3-benzodioxol-5-yl)-6-bromo-8-methoxy-3-nitro-2H-chromene Formula: C17H12BrNO6 MolecularWeight: 406.18428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)Br)C=C(C(O2)C3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

Isomeric SMILES

COC1=C2C(=CC(=C1)Br)C=C(C(O2)C3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

InChI

InChI=1S/C17H12BrNO6/c1-22-15-7-11(18)4-10-5-12(19(20)21)16(25-17(10)15)9-2-3-13-14(6-9)24-8-23-13/h2-7,16H,8H2,1H3