(2-oxidanylideneazepan-3-yl) 4-(4-fluorophenyl)-4-oxidanylidene-butanoate

Systemtic Name: (2-oxidanylideneazepan-3-yl) 4-(4-fluorophenyl)-4-oxidanylidene-butanoate Openeye Name: (2-oxoazepan-3-yl) 4-(4-fluorophenyl)-4-oxo-butanoate CAS Name: 4-(4-fluorophenyl)-4-oxobutanoic acid (2-oxo-3-azepanyl) ester IUPAC Name: (2-oxoazepan-3-yl) 4-(4-fluorophenyl)-4-oxobutanoate Traditional Name: 4-(4-fluorophenyl)-4-keto-butyric acid (2-ketoazepan-3-yl) ester Formula: C16H18FNO4 MolecularWeight: 307.316823

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)OC(=O)CCC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

C1CCNC(=O)C(C1)OC(=O)CCC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C16H18FNO4/c17-12-6-4-11(5-7-12)13(19)8-9-15(20)22-14-3-1-2-10-18-16(14)21/h4-7,14H,1-3,8-10H2,(H,18,21)