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

Systemtic Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-2-thiophen-3-yl-propanoic acid Openeye Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-2-(3-thienyl)propanoic acid CAS Name: 2-[[(1,3-benzodioxol-5-ylamino)-oxomethyl]amino]-2-(3-thiophenyl)propanoic acid IUPAC Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-2-thiophen-3-ylpropanoic acid Traditional Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-2-(3-thienyl)propionic acid Formula: C15H14N2O5S MolecularWeight: 334.34706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CSC=C1)(C(=O)O)NC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C1=CSC=C1)(C(=O)O)NC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H14N2O5S/c1-15(13(18)19,9-4-5-23-7-9)17-14(20)16-10-2-3-11-12(6-10)22-8-21-11/h2-7H,8H2,1H3,(H,18,19)(H2,16,17,20)