4-butyl-N-(3,3-dimethyl-4-oxidanylidene-5-prop-2-enyl-2H-1,5-benzoxazepin-7-yl)cyclohexane-1-carboxamide

Systemtic Name: 4-butyl-N-(3,3-dimethyl-4-oxidanylidene-5-prop-2-enyl-2H-1,5-benzoxazepin-7-yl)cyclohexane-1-carboxamide Openeye Name: N-(5-allyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)-4-butyl-cyclohexanecarboxamide CAS Name: 4-butyl-N-(3,3-dimethyl-4-oxo-5-prop-2-enyl-2H-1,5-benzoxazepin-7-yl)-1-cyclohexanecarboxamide IUPAC Name: 4-butyl-N-(3,3-dimethyl-4-oxo-5-prop-2-enyl-2H-1,5-benzoxazepin-7-yl)cyclohexane-1-carboxamide Traditional Name: N-(5-allyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-7-yl)-4-butyl-cyclohexanecarboxamide Formula: C25H36N2O3 MolecularWeight: 412.56494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)NC2=CC3=C(C=C2)OCC(C(=O)N3CC=C)(C)C

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)NC2=CC3=C(C=C2)OCC(C(=O)N3CC=C)(C)C

InChI

InChI=1S/C25H36N2O3/c1-5-7-8-18-9-11-19(12-10-18)23(28)26-20-13-14-22-21(16-20)27(15-6-2)24(29)25(3,4)17-30-22/h6,13-14,16,18-19H,2,5,7-12,15,17H2,1,3-4H3,(H,26,28)