N-(3,3-dimethyl-4-oxidanylidene-5-prop-2-enyl-2H-1,5-benzoxazepin-7-yl)-2-propyl-pentanamide

Systemtic Name: N-(3,3-dimethyl-4-oxidanylidene-5-prop-2-enyl-2H-1,5-benzoxazepin-7-yl)-2-propyl-pentanamide Openeye Name: N-(5-allyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)-2-propyl-pentanamide CAS Name: N-(3,3-dimethyl-4-oxo-5-prop-2-enyl-2H-1,5-benzoxazepin-7-yl)-2-propylpentanamide IUPAC Name: N-(3,3-dimethyl-4-oxo-5-prop-2-enyl-2H-1,5-benzoxazepin-7-yl)-2-propylpentanamide Traditional Name: N-(5-allyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-7-yl)-2-propyl-valeramide Formula: C22H32N2O3 MolecularWeight: 372.50108

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)NC1=CC2=C(C=C1)OCC(C(=O)N2CC=C)(C)C

Isomeric SMILES

CCCC(CCC)C(=O)NC1=CC2=C(C=C1)OCC(C(=O)N2CC=C)(C)C

InChI

InChI=1S/C22H32N2O3/c1-6-9-16(10-7-2)20(25)23-17-11-12-19-18(14-17)24(13-8-3)21(26)22(4,5)15-27-19/h8,11-12,14,16H,3,6-7,9-10,13,15H2,1-2,4-5H3,(H,23,25)