5-azanyl-5-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)pentanoic acid

Systemtic Name: 5-azanyl-5-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)pentanoic acid Openeye Name: 5-amino-5-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)pentanoic acid CAS Name: 5-amino-5-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)pentanoic acid IUPAC Name: 5-amino-5-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)pentanoic acid Traditional Name: 5-amino-5-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)valeric acid Formula: C13H16BrNO4 MolecularWeight: 330.17444

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Br)C(CCCC(=O)O)N

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Br)C(CCCC(=O)O)N

InChI

InChI=1S/C13H16BrNO4/c14-9-7-12-11(18-4-5-19-12)6-8(9)10(15)2-1-3-13(16)17/h6-7,10H,1-5,15H2,(H,16,17)