(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 3-(2-phenylethanoylamino)propanoate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 3-(2-phenylethanoylamino)propanoate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 3-[(2-phenylacetyl)amino]propanoate CAS Name: 3-[(1-oxo-2-phenylethyl)amino]propanoic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 3-[(2-phenylacetyl)amino]propanoate Traditional Name: 3-[(2-phenylacetyl)amino]propionic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C25H21NO5 MolecularWeight: 415.43794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NCCC(=O)OCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NCCC(=O)OCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3

InChI

InChI=1S/C25H21NO5/c27-22(14-17-6-2-1-3-7-17)26-13-12-23(28)30-16-19-15-24(29)31-21-11-10-18-8-4-5-9-20(18)25(19)21/h1-11,15H,12-14,16H2,(H,26,27)