7-chloranyl-4-cyclopentyl-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepine-5-carboxylic acid

Systemtic Name: 7-chloranyl-4-cyclopentyl-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepine-5-carboxylic acid Openeye Name: 7-chloro-4-cyclopentyl-2-ethyl-3-oxo-5H-1,4-benzoxazepine-5-carboxylic acid CAS Name: 7-chloro-4-cyclopentyl-2-ethyl-3-oxo-5H-1,4-benzoxazepine-5-carboxylic acid IUPAC Name: 7-chloro-4-cyclopentyl-2-ethyl-3-oxo-5H-1,4-benzoxazepine-5-carboxylic acid Traditional Name: 7-chloro-4-cyclopentyl-2-ethyl-3-keto-5H-1,4-benzoxazepine-5-carboxylic acid Formula: C17H20ClNO4 MolecularWeight: 337.798

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20ClNO4/c1-2-13-16(20)19(11-5-3-4-6-11)15(17(21)22)12-9-10(18)7-8-14(12)23-13/h7-9,11,13,15H,2-6H2,1H3,(H,21,22)