3-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]propanoic acid

Systemtic Name: 3-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]propanoic acid Openeye Name: 3-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]propanoic acid CAS Name: 3-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]propanoic acid IUPAC Name: 3-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]propanoic acid Traditional Name: 3-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]propionic acid Formula: C9H18N2O4S MolecularWeight: 250.31522

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)S(=O)(=O)CCC(=O)O

Isomeric SMILES

CN1CCCN(CC1)S(=O)(=O)CCC(=O)O

InChI

InChI=1S/C9H18N2O4S/c1-10-4-2-5-11(7-6-10)16(14,15)8-3-9(12)13/h2-8H2,1H3,(H,12,13)