5-azanyl-5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pentanoic acid

Systemtic Name: 5-azanyl-5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pentanoic acid Openeye Name: 5-amino-5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pentanoic acid CAS Name: 5-amino-5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pentanoic acid IUPAC Name: 5-amino-5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pentanoic acid Traditional Name: 5-amino-5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)valeric acid Formula: C14H19NO4 MolecularWeight: 265.30496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO4/c15-11(3-1-4-14(16)17)10-5-6-12-13(9-10)19-8-2-7-18-12/h5-6,9,11H,1-4,7-8,15H2,(H,16,17)