6-(3-chloranylpropyl)-2,3-dimethoxy-9-nitro-indeno[1,2-c]isoquinoline-5,11-dione

Systemtic Name: 6-(3-chloranylpropyl)-2,3-dimethoxy-9-nitro-indeno[1,2-c]isoquinoline-5,11-dione Openeye Name: 6-(3-chloropropyl)-2,3-dimethoxy-9-nitro-indeno[1,2-c]isoquinoline-5,11-dione CAS Name: 6-(3-chloropropyl)-2,3-dimethoxy-9-nitroindeno[1,2-c]isoquinoline-5,11-dione IUPAC Name: 6-(3-chloropropyl)-2,3-dimethoxy-9-nitroindeno[1,2-c]isoquinoline-5,11-dione Traditional Name: 6-(3-chloropropyl)-2,3-dimethoxy-9-nitro-inden[1,2-c]isoquinoline-5,11-quinone Formula: C21H17ClN2O6 MolecularWeight: 428.82248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C3=C(C4=C(C3=O)C=C(C=C4)[N+](=O)[O-])N(C2=O)CCCCl)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C3=C(C4=C(C3=O)C=C(C=C4)[N+](=O)[O-])N(C2=O)CCCCl)OC

InChI

InChI=1S/C21H17ClN2O6/c1-29-16-9-13-15(10-17(16)30-2)21(26)23(7-3-6-22)19-12-5-4-11(24(27)28)8-14(12)20(25)18(13)19/h4-5,8-10H,3,6-7H2,1-2H3