2-(1-methylpiperidin-4-yl)-6-nitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(1-methylpiperidin-4-yl)-6-nitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(1-methyl-4-piperidyl)-6-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(1-methyl-4-piperidinyl)-6-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(1-methylpiperidin-4-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(1-methyl-4-piperidyl)-6-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O

Isomeric SMILES

CN1CCC(CC1)N2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O

InChI

InChI=1S/C18H17N3O4/c1-19-9-7-11(8-10-19)20-17(22)13-4-2-3-12-15(21(24)25)6-5-14(16(12)13)18(20)23/h2-6,11H,7-10H2,1H3