N-tert-butyl-7-chloranyl-4-cyclopentyl-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepine-5-carboxamide

Systemtic Name: N-tert-butyl-7-chloranyl-4-cyclopentyl-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepine-5-carboxamide Openeye Name: N-tert-butyl-7-chloro-4-cyclopentyl-2-ethyl-3-oxo-5H-1,4-benzoxazepine-5-carboxamide CAS Name: N-tert-butyl-7-chloro-4-cyclopentyl-2-ethyl-3-oxo-5H-1,4-benzoxazepine-5-carboxamide IUPAC Name: N-tert-butyl-7-chloro-4-cyclopentyl-2-ethyl-3-oxo-5H-1,4-benzoxazepine-5-carboxamide Traditional Name: N-tert-butyl-7-chloro-4-cyclopentyl-2-ethyl-3-keto-5H-1,4-benzoxazepine-5-carboxamide Formula: C21H29ClN2O3 MolecularWeight: 392.91956

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C(C2=C(O1)C=CC(=C2)Cl)C(=O)NC(C)(C)C)C3CCCC3

Isomeric SMILES

CCC1C(=O)N(C(C2=C(O1)C=CC(=C2)Cl)C(=O)NC(C)(C)C)C3CCCC3

InChI

InChI=1S/C21H29ClN2O3/c1-5-16-20(26)24(14-8-6-7-9-14)18(19(25)23-21(2,3)4)15-12-13(22)10-11-17(15)27-16/h10-12,14,16,18H,5-9H2,1-4H3,(H,23,25)