[1-(butylcarbamoyl)-2-oxidanylidene-azepan-3-yl]carbamic acid

Systemtic Name: [1-(butylcarbamoyl)-2-oxidanylidene-azepan-3-yl]carbamic acid Openeye Name: [1-(butylcarbamoyl)-2-oxo-azepan-3-yl]carbamic acid CAS Name: [1-[butylamino(oxo)methyl]-2-oxo-3-azepanyl]carbamic acid IUPAC Name: [1-(butylcarbamoyl)-2-oxoazepan-3-yl]carbamic acid Traditional Name: [1-(butylcarbamoyl)-2-keto-azepan-3-yl]carbamic acid Formula: C12H21N3O4 MolecularWeight: 271.31284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1CCCCC(C1=O)NC(=O)O

Isomeric SMILES

CCCCNC(=O)N1CCCCC(C1=O)NC(=O)O

InChI

InChI=1S/C12H21N3O4/c1-2-3-7-13-11(17)15-8-5-4-6-9(10(15)16)14-12(18)19/h9,14H,2-8H2,1H3,(H,13,17)(H,18,19)