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

Systemtic Name: N-[3,3-dimethyl-5-(2-methylpropyl)-4-oxidanylidene-2H-1,5-benzoxazepin-7-yl]pentanamide Openeye Name: N-(5-isobutyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)pentanamide CAS Name: N-[3,3-dimethyl-5-(2-methylpropyl)-4-oxo-2H-1,5-benzoxazepin-7-yl]pentanamide IUPAC Name: N-[3,3-dimethyl-5-(2-methylpropyl)-4-oxo-2H-1,5-benzoxazepin-7-yl]pentanamide Traditional Name: N-(5-isobutyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-7-yl)valeramide Formula: C20H30N2O3 MolecularWeight: 346.4638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC2=C(C=C1)OCC(C(=O)N2CC(C)C)(C)C

Isomeric SMILES

CCCCC(=O)NC1=CC2=C(C=C1)OCC(C(=O)N2CC(C)C)(C)C

InChI

InChI=1S/C20H30N2O3/c1-6-7-8-18(23)21-15-9-10-17-16(11-15)22(12-14(2)3)19(24)20(4,5)13-25-17/h9-11,14H,6-8,12-13H2,1-5H3,(H,21,23)