(3-oxidanylidenebenzo[f]chromen-1-yl)methyl (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl (2S)-2-(benzyloxycarbonylamino)-3-phenyl-propanoate CAS Name: (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-phenyl-propionic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C31H25NO6 MolecularWeight: 507.5333

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)NC(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)OCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)NC(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C31H25NO6/c33-28-18-24(29-25-14-8-7-13-23(25)15-16-27(29)38-28)20-36-30(34)26(17-21-9-3-1-4-10-21)32-31(35)37-19-22-11-5-2-6-12-22/h1-16,18,26H,17,19-20H2,(H,32,35)/t26-/m0/s1