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

Systemtic Name: 4-chloranyl-N-[4-(cyclopropylmethyl)-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzamide Openeye Name: 4-chloro-N-[4-(cyclopropylmethyl)-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide CAS Name: 4-chloro-N-[4-(cyclopropylmethyl)-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide IUPAC Name: 4-chloro-N-[4-(cyclopropylmethyl)-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide Traditional Name: 4-chloro-N-[4-(cyclopropylmethyl)-2-ethyl-3-keto-5H-1,4-benzoxazepin-7-yl]benzamide Formula: C22H23ClN2O3 MolecularWeight: 398.88262

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)Cl)CC4CC4

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)Cl)CC4CC4

InChI

InChI=1S/C22H23ClN2O3/c1-2-19-22(27)25(12-14-3-4-14)13-16-11-18(9-10-20(16)28-19)24-21(26)15-5-7-17(23)8-6-15/h5-11,14,19H,2-4,12-13H2,1H3,(H,24,26)