N-[4-(3-methylbutyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzamide

Systemtic Name: N-[4-(3-methylbutyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzamide Openeye Name: N-(4-isopentyl-3-oxo-5H-1,4-benzoxazepin-7-yl)benzamide CAS Name: N-[4-(3-methylbutyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide IUPAC Name: N-[4-(3-methylbutyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide Traditional Name: N-(4-isoamyl-3-keto-5H-1,4-benzoxazepin-7-yl)benzamide Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1CC2=C(C=CC(=C2)NC(=O)C3=CC=CC=C3)OCC1=O

Isomeric SMILES

CC(C)CCN1CC2=C(C=CC(=C2)NC(=O)C3=CC=CC=C3)OCC1=O

InChI

InChI=1S/C21H24N2O3/c1-15(2)10-11-23-13-17-12-18(8-9-19(17)26-14-20(23)24)22-21(25)16-6-4-3-5-7-16/h3-9,12,15H,10-11,13-14H2,1-2H3,(H,22,25)