6-(azepan-1-yl)-5,5-diisocyanato-6-oxidanylidene-hexanamide

Systemtic Name: 6-(azepan-1-yl)-5,5-diisocyanato-6-oxidanylidene-hexanamide Openeye Name: 6-(azepan-1-yl)-5,5-diisocyanato-6-oxo-hexanamide CAS Name: 6-(1-azepanyl)-5,5-diisocyanato-6-oxohexanamide IUPAC Name: 6-(azepan-1-yl)-5,5-diisocyanato-6-oxohexanamide Traditional Name: 6-(azepan-1-yl)-5,5-diisocyanato-6-keto-hexanamide Formula: C14H20N4O4 MolecularWeight: 308.333

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C(CCCC(=O)N)(N=C=O)N=C=O

Isomeric SMILES

C1CCCN(CC1)C(=O)C(CCCC(=O)N)(N=C=O)N=C=O

InChI

InChI=1S/C14H20N4O4/c15-12(21)6-5-7-14(16-10-19,17-11-20)13(22)18-8-3-1-2-4-9-18/h1-9H2,(H2,15,21)