6-(3-bromanylpropyl)-7,8-dimethoxy-3-nitro-indeno[1,2-c]isoquinoline-5,11-dione

Systemtic Name: 6-(3-bromanylpropyl)-7,8-dimethoxy-3-nitro-indeno[1,2-c]isoquinoline-5,11-dione Openeye Name: 6-(3-bromopropyl)-7,8-dimethoxy-3-nitro-indeno[1,2-c]isoquinoline-5,11-dione CAS Name: 6-(3-bromopropyl)-7,8-dimethoxy-3-nitroindeno[1,2-c]isoquinoline-5,11-dione IUPAC Name: 6-(3-bromopropyl)-7,8-dimethoxy-3-nitroindeno[1,2-c]isoquinoline-5,11-dione Traditional Name: 6-(3-bromopropyl)-7,8-dimethoxy-3-nitro-inden[1,2-c]isoquinoline-5,11-quinone Formula: C21H17BrN2O6 MolecularWeight: 473.27348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(=O)C3=C2N(C(=O)C4=C3C=CC(=C4)[N+](=O)[O-])CCCBr)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(=O)C3=C2N(C(=O)C4=C3C=CC(=C4)[N+](=O)[O-])CCCBr)OC

InChI

InChI=1S/C21H17BrN2O6/c1-29-15-7-6-13-17(20(15)30-2)18-16(19(13)25)12-5-4-11(24(27)28)10-14(12)21(26)23(18)9-3-8-22/h4-7,10H,3,8-9H2,1-2H3