2,2-dimethyl-N-[(2R,3S)-2-methyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzoxazepin-3-yl]-N'-pentyl-propanediamide

Systemtic Name: 2,2-dimethyl-N-[(2R,3S)-2-methyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzoxazepin-3-yl]-N'-pentyl-propanediamide Openeye Name: 2,2-dimethyl-N-[(2R,3S)-2-methyl-4-oxo-3,5-dihydro-2H-1,5-benzoxazepin-3-yl]-N'-pentyl-propanediamide CAS Name: 2,2-dimethyl-N-[(2R,3S)-2-methyl-4-oxo-3,5-dihydro-2H-1,5-benzoxazepin-3-yl]-N'-pentylpropanediamide IUPAC Name: 2,2-dimethyl-N-[(2R,3S)-2-methyl-4-oxo-3,5-dihydro-2H-1,5-benzoxazepin-3-yl]-N'-pentylpropanediamide Traditional Name: N-amyl-N'-[(2R,3S)-4-keto-2-methyl-3,5-dihydro-2H-1,5-benzoxazepin-3-yl]-2,2-dimethyl-malonamide Formula: C20H29N3O4 MolecularWeight: 375.46196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C(C)(C)C(=O)NC1C(OC2=CC=CC=C2NC1=O)C

Isomeric SMILES

CCCCCNC(=O)C(C)(C)C(=O)N[C@H]1[C@H](OC2=CC=CC=C2NC1=O)C

InChI

InChI=1S/C20H29N3O4/c1-5-6-9-12-21-18(25)20(3,4)19(26)23-16-13(2)27-15-11-8-7-10-14(15)22-17(16)24/h7-8,10-11,13,16H,5-6,9,12H2,1-4H3,(H,21,25)(H,22,24)(H,23,26)/t13-,16+/m1/s1