2-[2-(3-azanylpropylamino)ethylamino]-5-nitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[2-(3-azanylpropylamino)ethylamino]-5-nitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-[2-(3-aminopropylamino)ethylamino]-5-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-[2-(3-aminopropylamino)ethylamino]-5-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-[2-(3-aminopropylamino)ethylamino]-5-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-[2-(3-aminopropylamino)ethylamino]-5-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C17H19N5O4 MolecularWeight: 357.36386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC(=CC3=C2C(=C1)C(=O)N(C3=O)NCCNCCCN)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=CC(=CC3=C2C(=C1)C(=O)N(C3=O)NCCNCCCN)[N+](=O)[O-]

InChI

InChI=1S/C17H19N5O4/c18-5-2-6-19-7-8-20-21-16(23)13-4-1-3-11-9-12(22(25)26)10-14(15(11)13)17(21)24/h1,3-4,9-10,19-20H,2,5-8,18H2