(6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 2-acetamido-2-cyclopentyl-ethanoate

Systemtic Name: (6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 2-acetamido-2-cyclopentyl-ethanoate Openeye Name: (6-chloro-7-ethyl-2-oxo-chromen-4-yl)methyl 2-acetamido-2-cyclopentyl-acetate CAS Name: 2-acetamido-2-cyclopentylacetic acid (6-chloro-7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-ethyl-2-oxochromen-4-yl)methyl 2-acetamido-2-cyclopentylacetate Traditional Name: 2-acetamido-2-cyclopentyl-acetic acid (6-chloro-7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C21H24ClNO5 MolecularWeight: 405.87196

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C(C3CCCC3)NC(=O)C)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C(C3CCCC3)NC(=O)C)Cl

InChI

InChI=1S/C21H24ClNO5/c1-3-13-8-18-16(10-17(13)22)15(9-19(25)28-18)11-27-21(26)20(23-12(2)24)14-6-4-5-7-14/h8-10,14,20H,3-7,11H2,1-2H3,(H,23,24)