(2S)-2-(1,3-benzodioxol-5-ylcarbamoylamino)-3-phenyl-propanoate

Systemtic Name: (2S)-2-(1,3-benzodioxol-5-ylcarbamoylamino)-3-phenyl-propanoate Openeye Name: (2S)-2-(1,3-benzodioxol-5-ylcarbamoylamino)-3-phenyl-propanoate CAS Name: (2S)-2-[[(1,3-benzodioxol-5-ylamino)-oxomethyl]amino]-3-phenylpropanoate IUPAC Name: (2S)-2-(1,3-benzodioxol-5-ylcarbamoylamino)-3-phenylpropanoate Traditional Name: (2S)-2-(1,3-benzodioxol-5-ylcarbamoylamino)-3-phenyl-propionate Formula: C17H15N2O5- MolecularWeight: 327.3114

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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)N[C@@H](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)/p-1/t13-/m0/s1