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

Systemtic Name: 4-oxidanylidene-4-[(3S,7E)-3-phenyl-7-(phenylmethylidene)-3,4,5,6-tetrahydro-1H-indazol-2-yl]butanoate Openeye Name: 4-[(3S,7E)-7-benzylidene-3-phenyl-3,4,5,6-tetrahydro-1H-indazol-2-yl]-4-oxo-butanoate CAS Name: 4-oxo-4-[(3S,7E)-3-phenyl-7-(phenylmethylene)-3,4,5,6-tetrahydro-1H-indazol-2-yl]butanoate IUPAC Name: 4-[(3S,7E)-7-benzylidene-3-phenyl-3,4,5,6-tetrahydro-1H-indazol-2-yl]-4-oxobutanoate Traditional Name: 4-[(3S,7E)-7-benzal-3-phenyl-3,4,5,6-tetrahydro-1H-indazol-2-yl]-4-keto-butyrate Formula: C24H23N2O3- MolecularWeight: 387.45102

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=CC=CC=C2)C3=C(C1)C(N(N3)C(=O)CCC(=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1C/C(=C\C2=CC=CC=C2)/C3=C(C1)[C@@H](N(N3)C(=O)CCC(=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C24H24N2O3/c27-21(14-15-22(28)29)26-24(18-10-5-2-6-11-18)20-13-7-12-19(23(20)25-26)16-17-8-3-1-4-9-17/h1-6,8-11,16,24-25H,7,12-15H2,(H,28,29)/p-1/b19-16+/t24-/m0/s1