methyl 4-[[(2S)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanoyl]amino]benzoate

Systemtic Name: methyl 4-[[(2S)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanoyl]amino]benzoate Openeye Name: methyl 4-[[(2S)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanoyl]amino]benzoate CAS Name: 4-[[(2S)-1-oxo-2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]propyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2S)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanoyl]amino]benzoate Traditional Name: 4-[[(2S)-2-[[(E)-3-phenylacryloyl]amino]propanoyl]amino]benzoic acid methyl ester Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)OC)NC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)C(=O)OC)NC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C20H20N2O4/c1-14(21-18(23)13-8-15-6-4-3-5-7-15)19(24)22-17-11-9-16(10-12-17)20(25)26-2/h3-14H,1-2H3,(H,21,23)(H,22,24)/b13-8+/t14-/m0/s1