3,4-bis(chloranyl)-N-[4-(cyclopropylmethyl)-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzamide

Systemtic Name: 3,4-bis(chloranyl)-N-[4-(cyclopropylmethyl)-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzamide Openeye Name: 3,4-dichloro-N-[4-(cyclopropylmethyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide CAS Name: 3,4-dichloro-N-[4-(cyclopropylmethyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide IUPAC Name: 3,4-dichloro-N-[4-(cyclopropylmethyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide Traditional Name: 3,4-dichloro-N-[4-(cyclopropylmethyl)-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl]benzamide Formula: C21H20Cl2N2O3 MolecularWeight: 419.3011

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC(=C(C=C3)Cl)Cl)CC4CC4

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC(=C(C=C3)Cl)Cl)CC4CC4

InChI

InChI=1S/C21H20Cl2N2O3/c1-12-21(27)25(10-13-2-3-13)11-15-8-16(5-7-19(15)28-12)24-20(26)14-4-6-17(22)18(23)9-14/h4-9,12-13H,2-3,10-11H2,1H3,(H,24,26)