4-oxidanylidene-4-(5-oxidanylidene-1,4-diazepan-1-yl)butanoate

Systemtic Name: 4-oxidanylidene-4-(5-oxidanylidene-1,4-diazepan-1-yl)butanoate Openeye Name: 4-oxo-4-(5-oxo-1,4-diazepan-1-yl)butanoate CAS Name: 4-oxo-4-(5-oxo-1,4-diazepan-1-yl)butanoate IUPAC Name: 4-oxo-4-(5-oxo-1,4-diazepan-1-yl)butanoate Traditional Name: 4-keto-4-(5-keto-1,4-diazepan-1-yl)butyrate Formula: C9H13N2O4- MolecularWeight: 213.21052

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCNC1=O)C(=O)CCC(=O)[O-]

Isomeric SMILES

C1CN(CCNC1=O)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C9H14N2O4/c12-7-3-5-11(6-4-10-7)8(13)1-2-9(14)15/h1-6H2,(H,10,12)(H,14,15)/p-1