6-(3-chloranylpropyl)-3-nitro-5,11-bis(oxidanylidene)indeno[1,2-c]isoquinoline-9-carbonitrile

Systemtic Name: 6-(3-chloranylpropyl)-3-nitro-5,11-bis(oxidanylidene)indeno[1,2-c]isoquinoline-9-carbonitrile Openeye Name: 6-(3-chloropropyl)-3-nitro-5,11-dioxo-indeno[1,2-c]isoquinoline-9-carbonitrile CAS Name: 6-(3-chloropropyl)-3-nitro-5,11-dioxo-9-indeno[1,2-c]isoquinolinecarbonitrile IUPAC Name: 6-(3-chloropropyl)-3-nitro-5,11-dioxoindeno[1,2-c]isoquinoline-9-carbonitrile Traditional Name: 6-(3-chloropropyl)-5,11-diketo-3-nitro-inden[1,2-c]isoquinoline-9-carbonitrile Formula: C20H12ClN3O4 MolecularWeight: 393.77998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C#N)C(=O)C3=C2N(C(=O)C4=C3C=CC(=C4)[N+](=O)[O-])CCCCl

Isomeric SMILES

C1=CC2=C(C=C1C#N)C(=O)C3=C2N(C(=O)C4=C3C=CC(=C4)[N+](=O)[O-])CCCCl

InChI

InChI=1S/C20H12ClN3O4/c21-6-1-7-23-18-14-4-2-11(10-22)8-15(14)19(25)17(18)13-5-3-12(24(27)28)9-16(13)20(23)26/h2-5,8-9H,1,6-7H2