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

Systemtic Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-3-phenyl-propanoic acid Openeye Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-3-phenyl-propanoic acid CAS Name: 2-[[(1,3-benzodioxol-5-ylamino)-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-3-phenylpropanoic acid Traditional Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-3-phenyl-propionic acid Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O5/c20-16(21)13(8-11-4-2-1-3-5-11)19-17(22)18-12-6-7-14-15(9-12)24-10-23-14/h1-7,9,13H,8,10H2,(H,20,21)(H2,18,19,22)