4-(2-chloranylethanoyl)-1,4-diazepane-1-carboxylic acid

Systemtic Name: 4-(2-chloranylethanoyl)-1,4-diazepane-1-carboxylic acid Openeye Name: 4-(2-chloroacetyl)-1,4-diazepane-1-carboxylic acid CAS Name: 4-(2-chloro-1-oxoethyl)-1,4-diazepane-1-carboxylic acid IUPAC Name: 4-(2-chloroacetyl)-1,4-diazepane-1-carboxylic acid Traditional Name: 4-(2-chloroacetyl)-1,4-diazepane-1-carboxylic acid Formula: C8H13ClN2O3 MolecularWeight: 220.65342

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)O)C(=O)CCl

Isomeric SMILES

C1CN(CCN(C1)C(=O)O)C(=O)CCl

InChI

InChI=1S/C8H13ClN2O3/c9-6-7(12)10-2-1-3-11(5-4-10)8(13)14/h1-6H2,(H,13,14)