2-[(5S)-3-(4-chlorophenyl)-5-(cycloheptylcarbamoyl)-4H-1,2-oxazol-5-yl]ethanoate

Systemtic Name: 2-[(5S)-3-(4-chlorophenyl)-5-(cycloheptylcarbamoyl)-4H-1,2-oxazol-5-yl]ethanoate Openeye Name: 2-[(5S)-3-(4-chlorophenyl)-5-(cycloheptylcarbamoyl)-4H-isoxazol-5-yl]acetate CAS Name: 2-[(5S)-3-(4-chlorophenyl)-5-[(cycloheptylamino)-oxomethyl]-4H-isoxazol-5-yl]acetate IUPAC Name: 2-[(5S)-3-(4-chlorophenyl)-5-(cycloheptylcarbamoyl)-4H-1,2-oxazol-5-yl]acetate Traditional Name: 2-[(5S)-3-(4-chlorophenyl)-5-(cycloheptylcarbamoyl)-2-isoxazolin-5-yl]acetate Formula: C19H22ClN2O4- MolecularWeight: 377.84198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2(CC(=NO2)C3=CC=C(C=C3)Cl)CC(=O)[O-]

Isomeric SMILES

C1CCCC(CC1)NC(=O)[C@]2(CC(=NO2)C3=CC=C(C=C3)Cl)CC(=O)[O-]

InChI

InChI=1S/C19H23ClN2O4/c20-14-9-7-13(8-10-14)16-11-19(26-22-16,12-17(23)24)18(25)21-15-5-3-1-2-4-6-15/h7-10,15H,1-6,11-12H2,(H,21,25)(H,23,24)/p-1/t19-/m0/s1