1-[(7Z)-3-phenyl-7-(phenylmethylidene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone

Systemtic Name: 1-[(7Z)-3-phenyl-7-(phenylmethylidene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone Openeye Name: 1-[(7Z)-7-benzylidene-3-phenyl-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone CAS Name: 1-[(7Z)-3-phenyl-7-(phenylmethylene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone IUPAC Name: 1-[(7Z)-7-benzylidene-3-phenyl-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone Traditional Name: 1-[(7Z)-7-benzal-3-phenyl-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone Formula: C22H22N2O MolecularWeight: 330.42288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(C2CCCC(=CC3=CC=CC=C3)C2=N1)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N1C(C2CCC/C(=C/C3=CC=CC=C3)/C2=N1)C4=CC=CC=C4

InChI

InChI=1S/C22H22N2O/c1-16(25)24-22(18-11-6-3-7-12-18)20-14-8-13-19(21(20)23-24)15-17-9-4-2-5-10-17/h2-7,9-12,15,20,22H,8,13-14H2,1H3/b19-15-