(3R)-N-[(2S)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl]-N-quinolin-3-yl-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3R)-N-[(2S)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl]-N-quinolin-3-yl-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3R)-N-[(1S)-2-(tert-butylamino)-1-methyl-2-oxo-ethyl]-N-(3-quinolyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3R)-N-[(2S)-1-(tert-butylamino)-1-oxopropan-2-yl]-N-(3-quinolinyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3R)-N-[(2S)-1-(tert-butylamino)-1-oxopropan-2-yl]-N-quinolin-3-yl-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3R)-N-[(1S)-2-(tert-butylamino)-2-keto-1-methyl-ethyl]-N-(3-quinolyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C25H27N3O4 MolecularWeight: 433.49958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)N(C1=CC2=CC=CC=C2N=C1)C(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

C[C@@H](C(=O)NC(C)(C)C)N(C1=CC2=CC=CC=C2N=C1)C(=O)[C@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C25H27N3O4/c1-16(23(29)27-25(2,3)4)28(18-13-17-9-5-6-10-19(17)26-14-18)24(30)22-15-31-20-11-7-8-12-21(20)32-22/h5-14,16,22H,15H2,1-4H3,(H,27,29)/t16-,22+/m0/s1