2-[[4-(3-methylbutoxy)phenyl]methylideneamino]-6-nitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[[4-(3-methylbutoxy)phenyl]methylideneamino]-6-nitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-[(4-isopentyloxyphenyl)methyleneamino]-6-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-[[4-(3-methylbutoxy)phenyl]methylideneamino]-6-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-[[4-(3-methylbutoxy)phenyl]methylideneamino]-6-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-[(4-isoamoxybenzylidene)amino]-6-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C24H21N3O5 MolecularWeight: 431.44064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C=NN2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C=NN2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O

InChI

InChI=1S/C24H21N3O5/c1-15(2)12-13-32-17-8-6-16(7-9-17)14-25-26-23(28)19-5-3-4-18-21(27(30)31)11-10-20(22(18)19)24(26)29/h3-11,14-15H,12-13H2,1-2H3