(2S)-2-tert-butyl-N-(2-chloranyl-5-nitro-phenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide

Systemtic Name: (2S)-2-tert-butyl-N-(2-chloranyl-5-nitro-phenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide Openeye Name: (2S)-2-tert-butyl-N-(2-chloro-5-nitro-phenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide CAS Name: (2S)-2-tert-butyl-N-(2-chloro-5-nitrophenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide IUPAC Name: (2S)-2-tert-butyl-N-(2-chloro-5-nitrophenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide Traditional Name: (2S)-2-tert-butyl-N-(2-chloro-5-nitro-phenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide Formula: C24H24ClN3O3 MolecularWeight: 437.91866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)(C)[C@H]1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C24H24ClN3O3/c1-24(2,3)14-8-11-20-17(12-14)22(16-6-4-5-7-19(16)26-20)23(29)27-21-13-15(28(30)31)9-10-18(21)25/h4-7,9-10,13-14H,8,11-12H2,1-3H3,(H,27,29)/t14-/m0/s1