2-azanyl-3,3-bis(1,3-benzodioxol-5-yl)propanoic acid

Systemtic Name: 2-azanyl-3,3-bis(1,3-benzodioxol-5-yl)propanoic acid Openeye Name: 2-amino-3,3-bis(1,3-benzodioxol-5-yl)propanoic acid CAS Name: 2-amino-3,3-bis(1,3-benzodioxol-5-yl)propanoic acid IUPAC Name: 2-amino-3,3-bis(1,3-benzodioxol-5-yl)propanoic acid Traditional Name: 2-amino-3,3-bis(1,3-benzodioxol-5-yl)propionic acid Formula: C17H15NO6 MolecularWeight: 329.3041

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(C3=CC4=C(C=C3)OCO4)C(C(=O)O)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(C3=CC4=C(C=C3)OCO4)C(C(=O)O)N

InChI

InChI=1S/C17H15NO6/c18-16(17(19)20)15(9-1-3-11-13(5-9)23-7-21-11)10-2-4-12-14(6-10)24-8-22-12/h1-6,15-16H,7-8,18H2,(H,19,20)