2-butyl-5-methoxy-7-phenyl-benzo[de]isoquinoline-1,6-dione

Systemtic Name: 2-butyl-5-methoxy-7-phenyl-benzo[de]isoquinoline-1,6-dione Openeye Name: 2-butyl-5-methoxy-7-phenyl-benzo[de]isoquinoline-1,6-dione CAS Name: 2-butyl-5-methoxy-7-phenylbenzo[de]isoquinoline-1,6-dione IUPAC Name: 2-butyl-5-methoxy-7-phenylbenzo[de]isoquinoline-1,6-dione Traditional Name: 2-butyl-5-methoxy-7-phenyl-benzo[de]isoquinoline-1,6-quinone Formula: C23H21NO3 MolecularWeight: 359.41774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C2C=C(C(=O)C3=C(C=CC(=C23)C1=O)C4=CC=CC=C4)OC

Isomeric SMILES

CCCCN1C=C2C=C(C(=O)C3=C(C=CC(=C23)C1=O)C4=CC=CC=C4)OC

InChI

InChI=1S/C23H21NO3/c1-3-4-12-24-14-16-13-19(27-2)22(25)21-17(15-8-6-5-7-9-15)10-11-18(20(16)21)23(24)26/h5-11,13-14H,3-4,12H2,1-2H3