(5-methyl-2-propan-2-yl-phenyl) (4Z)-3,6,6-trimethyl-4-(phenylhydrazinylidene)-5,7-dihydro-1-benzofuran-2-carboxylate

Systemtic Name: (5-methyl-2-propan-2-yl-phenyl) (4Z)-3,6,6-trimethyl-4-(phenylhydrazinylidene)-5,7-dihydro-1-benzofuran-2-carboxylate Openeye Name: (2-isopropyl-5-methyl-phenyl) (4Z)-3,6,6-trimethyl-4-(phenylhydrazono)-5,7-dihydrobenzofuran-2-carboxylate CAS Name: (4Z)-3,6,6-trimethyl-4-(phenylhydrazinylidene)-5,7-dihydrobenzofuran-2-carboxylic acid (5-methyl-2-propan-2-ylphenyl) ester IUPAC Name: (5-methyl-2-propan-2-ylphenyl) (4Z)-3,6,6-trimethyl-4-(phenylhydrazinylidene)-5,7-dihydro-1-benzofuran-2-carboxylate Traditional Name: (4Z)-3,6,6-trimethyl-4-(phenylhydrazono)-5,7-dihydrobenzofuran-2-carboxylic acid (2-isopropyl-5-methyl-phenyl) ester Formula: C28H32N2O3 MolecularWeight: 444.56528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OC(=O)C2=C(C3=C(O2)CC(CC3=NNC4=CC=CC=C4)(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OC(=O)C2=C(C\3=C(O2)CC(C/C3=N/NC4=CC=CC=C4)(C)C)C

InChI

InChI=1S/C28H32N2O3/c1-17(2)21-13-12-18(3)14-23(21)33-27(31)26-19(4)25-22(15-28(5,6)16-24(25)32-26)30-29-20-10-8-7-9-11-20/h7-14,17,29H,15-16H2,1-6H3/b30-22-