(2R)-2-[[(E)-2-[(4-methylphenyl)carbonylamino]-3-phenyl-prop-2-enoyl]amino]-3-phenyl-propanoate

Systemtic Name: (2R)-2-[[(E)-2-[(4-methylphenyl)carbonylamino]-3-phenyl-prop-2-enoyl]amino]-3-phenyl-propanoate Openeye Name: (2R)-2-[[(E)-2-[(4-methylbenzoyl)amino]-3-phenyl-prop-2-enoyl]amino]-3-phenyl-propanoate CAS Name: (2R)-2-[[(E)-2-[[(4-methylphenyl)-oxomethyl]amino]-1-oxo-3-phenylprop-2-enyl]amino]-3-phenylpropanoate IUPAC Name: (2R)-2-[[(E)-2-[(4-methylbenzoyl)amino]-3-phenylprop-2-enoyl]amino]-3-phenylpropanoate Traditional Name: (2R)-3-phenyl-2-[[(E)-3-phenyl-2-(p-toluoylamino)acryloyl]amino]propionate Formula: C26H23N2O4- MolecularWeight: 427.47182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=CC2=CC=CC=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N/C(=C/C2=CC=CC=C2)/C(=O)N[C@H](CC3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C26H24N2O4/c1-18-12-14-21(15-13-18)24(29)27-22(16-19-8-4-2-5-9-19)25(30)28-23(26(31)32)17-20-10-6-3-7-11-20/h2-16,23H,17H2,1H3,(H,27,29)(H,28,30)(H,31,32)/p-1/b22-16+/t23-/m1/s1