N-[4-(cyclopropylmethyl)-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-2,6-bis(fluoranyl)benzamide

Systemtic Name: N-[4-(cyclopropylmethyl)-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-2,6-bis(fluoranyl)benzamide Openeye Name: N-[4-(cyclopropylmethyl)-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-2,6-difluoro-benzamide CAS Name: N-[4-(cyclopropylmethyl)-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-2,6-difluorobenzamide IUPAC Name: N-[4-(cyclopropylmethyl)-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-2,6-difluorobenzamide Traditional Name: N-[4-(cyclopropylmethyl)-2-ethyl-3-keto-5H-1,4-benzoxazepin-7-yl]-2,6-difluoro-benzamide Formula: C22H22F2N2O3 MolecularWeight: 400.418486

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=C(C=CC=C3F)F)CC4CC4

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=C(C=CC=C3F)F)CC4CC4

InChI

InChI=1S/C22H22F2N2O3/c1-2-18-22(28)26(11-13-6-7-13)12-14-10-15(8-9-19(14)29-18)25-21(27)20-16(23)4-3-5-17(20)24/h3-5,8-10,13,18H,2,6-7,11-12H2,1H3,(H,25,27)