2-(4-cyanophenoxy)ethyl 4-(azepan-1-ylsulfonyl)benzoate

Systemtic Name: 2-(4-cyanophenoxy)ethyl 4-(azepan-1-ylsulfonyl)benzoate Openeye Name: 2-(4-cyanophenoxy)ethyl 4-(azepan-1-ylsulfonyl)benzoate CAS Name: 4-(1-azepanylsulfonyl)benzoic acid 2-(4-cyanophenoxy)ethyl ester IUPAC Name: 2-(4-cyanophenoxy)ethyl 4-(azepan-1-ylsulfonyl)benzoate Traditional Name: 4-(azepan-1-ylsulfonyl)benzoic acid 2-(4-cyanophenoxy)ethyl ester Formula: C22H24N2O5S MolecularWeight: 428.50136

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCCOC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCCOC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H24N2O5S/c23-17-18-5-9-20(10-6-18)28-15-16-29-22(25)19-7-11-21(12-8-19)30(26,27)24-13-3-1-2-4-14-24/h5-12H,1-4,13-16H2