2-ethylanthracene-9,10-dione; 5-phenyl-1H-pyrazol-3-amine

Systemtic Name: 2-ethylanthracene-9,10-dione; 5-phenyl-1H-pyrazol-3-amine Openeye Name: 2-ethylanthracene-9,10-dione; 5-phenyl-1H-pyrazol-3-amine CAS Name: 2-ethylanthracene-9,10-dione; 5-phenyl-1H-pyrazol-3-amine IUPAC Name: 2-ethylanthracene-9,10-dione; 5-phenyl-1H-pyrazol-3-amine Traditional Name: 2-ethyl-9,10-anthraquinone; (5-phenyl-1H-pyrazol-3-yl)amine Formula: C25H21N3O2 MolecularWeight: 395.45314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O.C1=CC=C(C=C1)C2=CC(=NN2)N

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O.C1=CC=C(C=C1)C2=CC(=NN2)N

InChI

InChI=1S/C16H12O2.C9H9N3/c1-2-10-7-8-13-14(9-10)16(18)12-6-4-3-5-11(12)15(13)17;10-9-6-8(11-12-9)7-4-2-1-3-5-7/h3-9H,2H2,1H3;1-6H,(H3,10,11,12)