1-(azepan-1-ylsulfonyl)-4-methoxy-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(azepan-1-ylsulfonyl)-4-methoxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-(azepan-1-ylsulfonyl)-4-methoxy-pyrrolidine-2-carboxylic acid CAS Name: 1-(1-azepanylsulfonyl)-4-methoxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(azepan-1-ylsulfonyl)-4-methoxypyrrolidine-2-carboxylic acid Traditional Name: 1-(azepan-1-ylsulfonyl)-4-methoxy-proline Formula: C12H22N2O5S MolecularWeight: 306.37848

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(N(C1)S(=O)(=O)N2CCCCCC2)C(=O)O

Isomeric SMILES

COC1CC(N(C1)S(=O)(=O)N2CCCCCC2)C(=O)O

InChI

InChI=1S/C12H22N2O5S/c1-19-10-8-11(12(15)16)14(9-10)20(17,18)13-6-4-2-3-5-7-13/h10-11H,2-9H2,1H3,(H,15,16)