N-[3,3-dimethyl-5-(3-methylbutyl)-4-oxidanylidene-2H-1,5-benzoxazepin-7-yl]-2-propyl-pentanamide

Systemtic Name: N-[3,3-dimethyl-5-(3-methylbutyl)-4-oxidanylidene-2H-1,5-benzoxazepin-7-yl]-2-propyl-pentanamide Openeye Name: N-(5-isopentyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)-2-propyl-pentanamide CAS Name: N-[3,3-dimethyl-5-(3-methylbutyl)-4-oxo-2H-1,5-benzoxazepin-7-yl]-2-propylpentanamide IUPAC Name: N-[3,3-dimethyl-5-(3-methylbutyl)-4-oxo-2H-1,5-benzoxazepin-7-yl]-2-propylpentanamide Traditional Name: N-(5-isoamyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-7-yl)-2-propyl-valeramide Formula: C24H38N2O3 MolecularWeight: 402.57012

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)NC1=CC2=C(C=C1)OCC(C(=O)N2CCC(C)C)(C)C

Isomeric SMILES

CCCC(CCC)C(=O)NC1=CC2=C(C=C1)OCC(C(=O)N2CCC(C)C)(C)C

InChI

InChI=1S/C24H38N2O3/c1-7-9-18(10-8-2)22(27)25-19-11-12-21-20(15-19)26(14-13-17(3)4)23(28)24(5,6)16-29-21/h11-12,15,17-18H,7-10,13-14,16H2,1-6H3,(H,25,27)