(2-oxidanylideneazepan-3-yl) 4-(oxolan-2-ylmethoxy)benzoate

Systemtic Name: (2-oxidanylideneazepan-3-yl) 4-(oxolan-2-ylmethoxy)benzoate Openeye Name: (2-oxoazepan-3-yl) 4-(tetrahydrofuran-2-ylmethoxy)benzoate CAS Name: 4-(2-oxolanylmethoxy)benzoic acid (2-oxo-3-azepanyl) ester IUPAC Name: (2-oxoazepan-3-yl) 4-(oxolan-2-ylmethoxy)benzoate Traditional Name: 4-(tetrahydrofurfuryloxy)benzoic acid (2-ketoazepan-3-yl) ester Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)OC(=O)C2=CC=C(C=C2)OCC3CCCO3

Isomeric SMILES

C1CCNC(=O)C(C1)OC(=O)C2=CC=C(C=C2)OCC3CCCO3

InChI

InChI=1S/C18H23NO5/c20-17-16(5-1-2-10-19-17)24-18(21)13-6-8-14(9-7-13)23-12-15-4-3-11-22-15/h6-9,15-16H,1-5,10-12H2,(H,19,20)