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

Systemtic Name: 2-(indol-3-ylidenemethylamino)-6-nitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(indol-3-ylidenemethylamino)-6-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(3-indolylidenemethylamino)-6-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(indol-3-ylidenemethylamino)-6-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(indol-3-ylidenemethylamino)-6-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C21H12N4O4 MolecularWeight: 384.34438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CNN3C(=O)C4=C5C(=C(C=C4)[N+](=O)[O-])C=CC=C5C3=O)C=N2

Isomeric SMILES

C1=CC=C2C(=C1)C(=CNN3C(=O)C4=C5C(=C(C=C4)[N+](=O)[O-])C=CC=C5C3=O)C=N2

InChI

InChI=1S/C21H12N4O4/c26-20-15-6-3-5-14-18(25(28)29)9-8-16(19(14)15)21(27)24(20)23-11-12-10-22-17-7-2-1-4-13(12)17/h1-11,23H