2-[(7-chloranyl-4-cyclopentyl-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepin-5-yl)carbonylamino]ethanoic acid

Systemtic Name: 2-[(7-chloranyl-4-cyclopentyl-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepin-5-yl)carbonylamino]ethanoic acid Openeye Name: 2-[(7-chloro-4-cyclopentyl-2-ethyl-3-oxo-5H-1,4-benzoxazepine-5-carbonyl)amino]acetic acid CAS Name: 2-[[(7-chloro-4-cyclopentyl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-5-yl)-oxomethyl]amino]acetic acid IUPAC Name: 2-[(7-chloro-4-cyclopentyl-2-ethyl-3-oxo-5H-1,4-benzoxazepine-5-carbonyl)amino]acetic acid Traditional Name: 2-[(7-chloro-4-cyclopentyl-2-ethyl-3-keto-5H-1,4-benzoxazepine-5-carbonyl)amino]acetic acid Formula: C19H23ClN2O5 MolecularWeight: 394.84932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23ClN2O5/c1-2-14-19(26)22(12-5-3-4-6-12)17(18(25)21-10-16(23)24)13-9-11(20)7-8-15(13)27-14/h7-9,12,14,17H,2-6,10H2,1H3,(H,21,25)(H,23,24)