furan-2-ylmethyl 3-(azepan-1-ylsulfonyl)benzoate

Systemtic Name: furan-2-ylmethyl 3-(azepan-1-ylsulfonyl)benzoate Openeye Name: 2-furylmethyl 3-(azepan-1-ylsulfonyl)benzoate CAS Name: 3-(1-azepanylsulfonyl)benzoic acid 2-furanylmethyl ester IUPAC Name: furan-2-ylmethyl 3-(azepan-1-ylsulfonyl)benzoate Traditional Name: 3-(azepan-1-ylsulfonyl)benzoic acid 2-furfuryl ester Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CC=CO3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CC=CO3

InChI

InChI=1S/C18H21NO5S/c20-18(24-14-16-8-6-12-23-16)15-7-5-9-17(13-15)25(21,22)19-10-3-1-2-4-11-19/h5-9,12-13H,1-4,10-11,14H2