N-(4-azanyl-4-oxidanylidene-butyl)-6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide

Systemtic Name: N-(4-azanyl-4-oxidanylidene-butyl)-6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: N-(4-amino-4-oxo-butyl)-6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: N-(4-amino-4-oxobutyl)-6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: N-(4-amino-4-oxobutyl)-6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: N-(4-amino-4-keto-butyl)-6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C14H17ClN2O4 MolecularWeight: 312.74878

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)C(=O)NCCCC(=O)N)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)C(=O)NCCCC(=O)N)Cl)OC1

InChI

InChI=1S/C14H17ClN2O4/c15-10-7-9(14(19)17-4-1-3-12(16)18)8-11-13(10)21-6-2-5-20-11/h7-8H,1-6H2,(H2,16,18)(H,17,19)