2-(3-methoxypropyl)-6-nitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(3-methoxypropyl)-6-nitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(3-methoxypropyl)-6-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(3-methoxypropyl)-6-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(3-methoxypropyl)-6-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(3-methoxypropyl)-6-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C16H14N2O5 MolecularWeight: 314.29276

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=C3C1=O

Isomeric SMILES

COCCCN1C(=O)C2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=C3C1=O

InChI

InChI=1S/C16H14N2O5/c1-23-9-3-8-17-15(19)11-5-2-4-10-13(18(21)22)7-6-12(14(10)11)16(17)20/h2,4-7H,3,8-9H2,1H3