(2R)-2-[[(2S)-2-benzamido-3-(1,3-benzodioxol-5-yl)propanoyl]amino]-3-phenyl-propanoate

Systemtic Name: (2R)-2-[[(2S)-2-benzamido-3-(1,3-benzodioxol-5-yl)propanoyl]amino]-3-phenyl-propanoate Openeye Name: (2R)-2-[[(2S)-2-benzamido-3-(1,3-benzodioxol-5-yl)propanoyl]amino]-3-phenyl-propanoate CAS Name: (2R)-2-[[(2S)-2-benzamido-3-(1,3-benzodioxol-5-yl)-1-oxopropyl]amino]-3-phenylpropanoate IUPAC Name: (2R)-2-[[(2S)-2-benzamido-3-(1,3-benzodioxol-5-yl)propanoyl]amino]-3-phenylpropanoate Traditional Name: (2R)-2-[[(2S)-2-benzamido-3-(1,3-benzodioxol-5-yl)propanoyl]amino]-3-phenyl-propionate Formula: C26H23N2O6- MolecularWeight: 459.47062

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CC(C(=O)NC(CC3=CC=CC=C3)C(=O)[O-])NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C[C@@H](C(=O)N[C@H](CC3=CC=CC=C3)C(=O)[O-])NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H24N2O6/c29-24(19-9-5-2-6-10-19)27-20(14-18-11-12-22-23(15-18)34-16-33-22)25(30)28-21(26(31)32)13-17-7-3-1-4-8-17/h1-12,15,20-21H,13-14,16H2,(H,27,29)(H,28,30)(H,31,32)/p-1/t20-,21+/m0/s1