3-(1,3-benzodioxol-5-yl)-3-(phenylcarbamoylamino)propanoic acid

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-3-(phenylcarbamoylamino)propanoic acid Openeye Name: 3-(1,3-benzodioxol-5-yl)-3-(phenylcarbamoylamino)propanoic acid CAS Name: 3-[[anilino(oxo)methyl]amino]-3-(1,3-benzodioxol-5-yl)propanoic acid IUPAC Name: 3-(1,3-benzodioxol-5-yl)-3-(phenylcarbamoylamino)propanoic acid Traditional Name: 3-(1,3-benzodioxol-5-yl)-3-(phenylcarbamoylamino)propionic acid Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(CC(=O)O)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(CC(=O)O)NC(=O)NC3=CC=CC=C3

InChI

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