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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(C2=C(N1)C(=CC3=CC=CC=C3)CCC2)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N1[C@H](C2=C(N1)/C(=C/C3=CC=CC=C3)/CCC2)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/h2-7,9-12,15,22-23H,8,13-14H2,1H3/b19-15+/t22-/m0/s1