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

Systemtic Name: 6-(3-azanylpropyl)-2,3-dimethoxy-5,11-bis(oxidanylidene)indeno[1,2-c]isoquinoline-9-carbonitrile Openeye Name: 6-(3-aminopropyl)-2,3-dimethoxy-5,11-dioxo-indeno[1,2-c]isoquinoline-9-carbonitrile CAS Name: 6-(3-aminopropyl)-2,3-dimethoxy-5,11-dioxo-9-indeno[1,2-c]isoquinolinecarbonitrile IUPAC Name: 6-(3-aminopropyl)-2,3-dimethoxy-5,11-dioxoindeno[1,2-c]isoquinoline-9-carbonitrile Traditional Name: 6-(3-aminopropyl)-5,11-diketo-2,3-dimethoxy-inden[1,2-c]isoquinoline-9-carbonitrile Formula: C22H19N3O4 MolecularWeight: 389.40396

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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)C#N)N(C2=O)CCCN)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C3=C(C4=C(C3=O)C=C(C=C4)C#N)N(C2=O)CCCN)OC

InChI

InChI=1S/C22H19N3O4/c1-28-17-9-14-16(10-18(17)29-2)22(27)25(7-3-6-23)20-13-5-4-12(11-24)8-15(13)21(26)19(14)20/h4-5,8-10H,3,6-7,23H2,1-2H3