5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-5-oxidanylidene-pentanoic acid Openeye Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-5-oxo-pentanoic acid CAS Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-5-oxopentanoic acid IUPAC Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-5-oxopentanoic acid Traditional Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-5-keto-valeric acid Formula: C14H17NO5 MolecularWeight: 279.28848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)CCCC(=O)O)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)CCCC(=O)O)OC1

InChI

InChI=1S/C14H17NO5/c16-13(3-1-4-14(17)18)15-10-5-6-11-12(9-10)20-8-2-7-19-11/h5-6,9H,1-4,7-8H2,(H,15,16)(H,17,18)