(2-oxidanylidenecyclohexyl) 4-(azepan-1-ylsulfonyl)benzoate

Systemtic Name: (2-oxidanylidenecyclohexyl) 4-(azepan-1-ylsulfonyl)benzoate Openeye Name: (2-oxocyclohexyl) 4-(azepan-1-ylsulfonyl)benzoate CAS Name: 4-(1-azepanylsulfonyl)benzoic acid (2-oxocyclohexyl) ester IUPAC Name: (2-oxocyclohexyl) 4-(azepan-1-ylsulfonyl)benzoate Traditional Name: 4-(azepan-1-ylsulfonyl)benzoic acid (2-ketocyclohexyl) ester Formula: C19H25NO5S MolecularWeight: 379.4705

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC3CCCCC3=O

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC3CCCCC3=O

InChI

InChI=1S/C19H25NO5S/c21-17-7-3-4-8-18(17)25-19(22)15-9-11-16(12-10-15)26(23,24)20-13-5-1-2-6-14-20/h9-12,18H,1-8,13-14H2