2-[2-azanyl-5-(1,3-benzodioxol-5-ylcarbonyl)phenyl]ethanoic acid

Systemtic Name: 2-[2-azanyl-5-(1,3-benzodioxol-5-ylcarbonyl)phenyl]ethanoic acid Openeye Name: 2-[2-amino-5-(1,3-benzodioxole-5-carbonyl)phenyl]acetic acid CAS Name: 2-[2-amino-5-[1,3-benzodioxol-5-yl(oxo)methyl]phenyl]acetic acid IUPAC Name: 2-[2-amino-5-(1,3-benzodioxole-5-carbonyl)phenyl]acetic acid Traditional Name: 2-(2-amino-5-piperonyloyl-phenyl)acetic acid Formula: C16H13NO5 MolecularWeight: 299.27812

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)C3=CC(=C(C=C3)N)CC(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)C3=CC(=C(C=C3)N)CC(=O)O

InChI

InChI=1S/C16H13NO5/c17-12-3-1-9(5-11(12)7-15(18)19)16(20)10-2-4-13-14(6-10)22-8-21-13/h1-6H,7-8,17H2,(H,18,19)