5-azanyl-2-[3-[4-(3-azanylpropylamino)butylamino]propyl]benzo[de]isoquinoline-1,3-dione

Systemtic Name: 5-azanyl-2-[3-[4-(3-azanylpropylamino)butylamino]propyl]benzo[de]isoquinoline-1,3-dione Openeye Name: 5-amino-2-[3-[4-(3-aminopropylamino)butylamino]propyl]benzo[de]isoquinoline-1,3-dione CAS Name: 5-amino-2-[3-[4-(3-aminopropylamino)butylamino]propyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 5-amino-2-[3-[4-(3-aminopropylamino)butylamino]propyl]benzo[de]isoquinoline-1,3-dione Traditional Name: 5-amino-2-[3-[4-(3-aminopropylamino)butylamino]propyl]benzo[de]isoquinoline-1,3-quinone Formula: C22H31N5O2 MolecularWeight: 397.51384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC(=CC3=C2C(=C1)C(=O)N(C3=O)CCCNCCCCNCCCN)N

Isomeric SMILES

C1=CC2=CC(=CC3=C2C(=C1)C(=O)N(C3=O)CCCNCCCCNCCCN)N

InChI

InChI=1S/C22H31N5O2/c23-8-4-11-25-9-1-2-10-26-12-5-13-27-21(28)18-7-3-6-16-14-17(24)15-19(20(16)18)22(27)29/h3,6-7,14-15,25-26H,1-2,4-5,8-13,23-24H2