(phenylmethyl) 2-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]prop-2-enoate

Systemtic Name: (phenylmethyl) 2-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]prop-2-enoate Openeye Name: benzyl 2-[[(2S)-2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]prop-2-enoate CAS Name: 2-[[(2S)-1-oxo-3-phenyl-2-(phenylmethoxycarbonylamino)propyl]amino]-2-propenoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]prop-2-enoate Traditional Name: 2-[[(2S)-2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]acrylic acid benzyl ester Formula: C27H26N2O5 MolecularWeight: 458.50574

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(=O)OCC1=CC=CC=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C=C(C(=O)OCC1=CC=CC=C1)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C27H26N2O5/c1-20(26(31)33-18-22-13-7-3-8-14-22)28-25(30)24(17-21-11-5-2-6-12-21)29-27(32)34-19-23-15-9-4-10-16-23/h2-16,24H,1,17-19H2,(H,28,30)(H,29,32)/t24-/m0/s1