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

Systemtic Name: [(E)-(3,6,6-trimethyl-1-phenyl-5,7-dihydroindazol-4-ylidene)amino] 4-methylbenzoate Openeye Name: [(E)-(3,6,6-trimethyl-1-phenyl-5,7-dihydroindazol-4-ylidene)amino] 4-methylbenzoate CAS Name: 4-methylbenzoic 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] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [(E)-(3,6,6-trimethyl-1-phenyl-5,7-dihydroindazol-4-ylidene)amino] ester Formula: C24H25N3O2 MolecularWeight: 387.4742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)ON=C2CC(CC3=C2C(=NN3C4=CC=CC=C4)C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)O/N=C/2\CC(CC3=C2C(=NN3C4=CC=CC=C4)C)(C)C

InChI

InChI=1S/C24H25N3O2/c1-16-10-12-18(13-11-16)23(28)29-26-20-14-24(3,4)15-21-22(20)17(2)25-27(21)19-8-6-5-7-9-19/h5-13H,14-15H2,1-4H3/b26-20+