(2R)-2-tert-butyl-4-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]-1,2,3,10-tetrahydroacridine-9-carboxylate

Systemtic Name: (2R)-2-tert-butyl-4-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]-1,2,3,10-tetrahydroacridine-9-carboxylate Openeye Name: (2R)-2-tert-butyl-4-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-1,2,3,10-tetrahydroacridine-9-carboxylate CAS Name: (2R)-2-tert-butyl-4-[(4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-1,2,3,10-tetrahydroacridine-9-carboxylate IUPAC Name: (2R)-2-tert-butyl-4-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-1,2,3,10-tetrahydroacridine-9-carboxylate Traditional Name: (2R)-2-tert-butyl-4-[(4-ketocyclohexa-2,5-dien-1-ylidene)methyl]-1,2,3,10-tetrahydroacridine-9-carboxylate Formula: C25H24NO3- MolecularWeight: 386.46296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CC(=C2C(=C(C3=CC=CC=C3N2)C(=O)[O-])C1)C=C4C=CC(=O)C=C4

Isomeric SMILES

CC(C)(C)[C@@H]1CC(=C2C(=C(C3=CC=CC=C3N2)C(=O)[O-])C1)C=C4C=CC(=O)C=C4

InChI

InChI=1S/C25H25NO3/c1-25(2,3)17-13-16(12-15-8-10-18(27)11-9-15)23-20(14-17)22(24(28)29)19-6-4-5-7-21(19)26-23/h4-12,17,26H,13-14H2,1-3H3,(H,28,29)/p-1/t17-/m1/s1