3-benzamido-6-chloranyl-4-fluoranyl-1-propan-2-yl-cyclohexa-2,4-diene-1-carboxylate

Systemtic Name: 3-benzamido-6-chloranyl-4-fluoranyl-1-propan-2-yl-cyclohexa-2,4-diene-1-carboxylate Openeye Name: 3-benzamido-6-chloro-4-fluoro-1-isopropyl-cyclohexa-2,4-diene-1-carboxylate CAS Name: 3-benzamido-6-chloro-4-fluoro-1-propan-2-yl-1-cyclohexa-2,4-dienecarboxylate IUPAC Name: 3-benzamido-6-chloro-4-fluoro-1-propan-2-ylcyclohexa-2,4-diene-1-carboxylate Traditional Name: 3-benzamido-6-chloro-4-fluoro-1-isopropyl-cyclohexa-2,4-diene-1-carboxylate Formula: C17H16ClFNO3- MolecularWeight: 336.765243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C=C(C(=CC1Cl)F)NC(=O)C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC(C)C1(C=C(C(=CC1Cl)F)NC(=O)C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C17H17ClFNO3/c1-10(2)17(16(22)23)9-13(12(19)8-14(17)18)20-15(21)11-6-4-3-5-7-11/h3-10,14H,1-2H3,(H,20,21)(H,22,23)/p-1