2-(2-piperazin-1-ylethyl)-5-(1,2,3-triazol-1-yl)benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(2-piperazin-1-ylethyl)-5-(1,2,3-triazol-1-yl)benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(2-piperazin-1-ylethyl)-5-(triazol-1-yl)benzo[de]isoquinoline-1,3-dione CAS Name: 2-[2-(1-piperazinyl)ethyl]-5-(1-triazolyl)benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(2-piperazin-1-ylethyl)-5-(triazol-1-yl)benzo[de]isoquinoline-1,3-dione Traditional Name: 2-(2-piperazinoethyl)-5-(triazol-1-yl)benzo[de]isoquinoline-1,3-quinone Formula: C20H20N6O2 MolecularWeight: 376.4118

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CCN2C(=O)C3=CC=CC4=CC(=CC(=C43)C2=O)N5C=CN=N5

Isomeric SMILES

C1CN(CCN1)CCN2C(=O)C3=CC=CC4=CC(=CC(=C43)C2=O)N5C=CN=N5

InChI

InChI=1S/C20H20N6O2/c27-19-16-3-1-2-14-12-15(26-9-6-22-23-26)13-17(18(14)16)20(28)25(19)11-10-24-7-4-21-5-8-24/h1-3,6,9,12-13,21H,4-5,7-8,10-11H2