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

Systemtic Name: 2-azido-1-[(7Z)-3-phenyl-7-(phenylmethylidene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone Openeye Name: 2-azido-1-[(7Z)-7-benzylidene-3-phenyl-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone CAS Name: 2-azido-1-[(7Z)-3-phenyl-7-(phenylmethylene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone IUPAC Name: 2-azido-1-[(7Z)-7-benzylidene-3-phenyl-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone Traditional Name: 2-azido-1-[(7Z)-7-benzal-3-phenyl-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone Formula: C22H21N5O MolecularWeight: 371.43504

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(N(N=C2C(=CC3=CC=CC=C3)C1)C(=O)CN=[N+]=[N-])C4=CC=CC=C4

Isomeric SMILES

C1CC2C(N(N=C2/C(=C\C3=CC=CC=C3)/C1)C(=O)CN=[N+]=[N-])C4=CC=CC=C4

InChI

InChI=1S/C22H21N5O/c23-26-24-15-20(28)27-22(17-10-5-2-6-11-17)19-13-7-12-18(21(19)25-27)14-16-8-3-1-4-9-16/h1-6,8-11,14,19,22H,7,12-13,15H2/b18-14-