[(E)-(3,6,6-trimethyl-1-phenyl-5,7-dihydroindazol-4-ylidene)amino] 2-oxidanylidenechromene-3-carboxylate

Systemtic Name: [(E)-(3,6,6-trimethyl-1-phenyl-5,7-dihydroindazol-4-ylidene)amino] 2-oxidanylidenechromene-3-carboxylate Openeye Name: [(E)-(3,6,6-trimethyl-1-phenyl-5,7-dihydroindazol-4-ylidene)amino] 2-oxochromene-3-carboxylate CAS Name: 2-oxo-1-benzopyran-3-carboxylic acid [(E)-(3,6,6-trimethyl-1-phenyl-5,7-dihydroindazol-4-ylidene)amino] ester IUPAC Name: [(E)-(3,6,6-trimethyl-1-phenyl-5,7-dihydroindazol-4-ylidene)amino] 2-oxochromene-3-carboxylate Traditional Name: 2-ketochromene-3-carboxylic acid [(E)-(3,6,6-trimethyl-1-phenyl-5,7-dihydroindazol-4-ylidene)amino] ester Formula: C26H23N3O4 MolecularWeight: 441.47852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=NOC(=O)C3=CC4=CC=CC=C4OC3=O)CC(C2)(C)C)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=C1/C(=N/OC(=O)C3=CC4=CC=CC=C4OC3=O)/CC(C2)(C)C)C5=CC=CC=C5

InChI

InChI=1S/C26H23N3O4/c1-16-23-20(14-26(2,3)15-21(23)29(27-16)18-10-5-4-6-11-18)28-33-25(31)19-13-17-9-7-8-12-22(17)32-24(19)30/h4-13H,14-15H2,1-3H3/b28-20+