2-(1,3-benzodioxol-5-ylcarbamoylamino)-3-(4-hydroxyphenyl)propanoic acid

Systemtic Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-3-(4-hydroxyphenyl)propanoic acid Openeye Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-3-(4-hydroxyphenyl)propanoic acid CAS Name: 2-[[(1,3-benzodioxol-5-ylamino)-oxomethyl]amino]-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-3-(4-hydroxyphenyl)propanoic acid Traditional Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-3-(4-hydroxyphenyl)propionic acid Formula: C17H16N2O6 MolecularWeight: 344.31874

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)NC(CC3=CC=C(C=C3)O)C(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)NC(CC3=CC=C(C=C3)O)C(=O)O

InChI

InChI=1S/C17H16N2O6/c20-12-4-1-10(2-5-12)7-13(16(21)22)19-17(23)18-11-3-6-14-15(8-11)25-9-24-14/h1-6,8,13,20H,7,9H2,(H,21,22)(H2,18,19,23)