6-bromanyl-2-[[1-(4-methoxyphenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methylamino]benzo[de]isoquinoline-1,3-dione

Systemtic Name: 6-bromanyl-2-[[1-(4-methoxyphenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methylamino]benzo[de]isoquinoline-1,3-dione Openeye Name: 6-bromo-2-[[1-(4-methoxyphenyl)-3-methyl-5-oxo-pyrazol-4-ylidene]methylamino]benzo[de]isoquinoline-1,3-dione CAS Name: 6-bromo-2-[[1-(4-methoxyphenyl)-3-methyl-5-oxo-4-pyrazolylidene]methylamino]benzo[de]isoquinoline-1,3-dione IUPAC Name: 6-bromo-2-[[1-(4-methoxyphenyl)-3-methyl-5-oxopyrazol-4-ylidene]methylamino]benzo[de]isoquinoline-1,3-dione Traditional Name: 6-bromo-2-[[5-keto-1-(4-methoxyphenyl)-3-methyl-2-pyrazolin-4-ylidene]methylamino]benzo[de]isoquinoline-1,3-quinone Formula: C24H17BrN4O4 MolecularWeight: 505.32018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNN2C(=O)C3=C4C(=C(C=C3)Br)C=CC=C4C2=O)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=NN(C(=O)C1=CNN2C(=O)C3=C4C(=C(C=C3)Br)C=CC=C4C2=O)C5=CC=C(C=C5)OC

InChI

InChI=1S/C24H17BrN4O4/c1-13-19(24(32)28(27-13)14-6-8-15(33-2)9-7-14)12-26-29-22(30)17-5-3-4-16-20(25)11-10-18(21(16)17)23(29)31/h3-12,26H,1-2H3