(2R,4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-tert-butyl-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: (2R,4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-tert-butyl-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: (2R,4Z)-4-(1,3-benzodioxol-5-ylmethylene)-2-tert-butyl-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (2R,4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-tert-butyl-2,3-dihydro-1H-acridine-9-carboxylate IUPAC Name: (2R,4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-tert-butyl-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (2R,4Z)-2-tert-butyl-4-piperonylidene-2,3-dihydro-1H-acridine-9-carboxylate Formula: C26H24NO4- MolecularWeight: 414.47306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CC(=CC2=CC3=C(C=C2)OCO3)C4=NC5=CC=CC=C5C(=C4C1)C(=O)[O-]

Isomeric SMILES

CC(C)(C)[C@@H]1C/C(=C/C2=CC3=C(C=C2)OCO3)/C4=NC5=CC=CC=C5C(=C4C1)C(=O)[O-]

InChI

InChI=1S/C26H25NO4/c1-26(2,3)17-12-16(10-15-8-9-21-22(11-15)31-14-30-21)24-19(13-17)23(25(28)29)18-6-4-5-7-20(18)27-24/h4-11,17H,12-14H2,1-3H3,(H,28,29)/p-1/b16-10-/t17-/m1/s1