(2-oxidanylidene-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate

Systemtic Name: (2-oxidanylidene-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate Openeye Name: (2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[(1-oxo-2-phenylethyl)amino]butanoic acid (2-oxo-7,8-dihydro-6H-cyclopenta[g][1]benzopyran-4-yl)methyl ester IUPAC Name: (2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(2-phenylacetyl)amino]butyric acid (2-keto-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl ester Formula: C26H27NO5 MolecularWeight: 433.49628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC(=O)OC2=CC3=C(CCC3)C=C12)NC(=O)CC4=CC=CC=C4

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC1=CC(=O)OC2=CC3=C(CCC3)C=C12)NC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C26H27NO5/c1-16(2)25(27-23(28)11-17-7-4-3-5-8-17)26(30)31-15-20-14-24(29)32-22-13-19-10-6-9-18(19)12-21(20)22/h3-5,7-8,12-14,16,25H,6,9-11,15H2,1-2H3,(H,27,28)/t25-/m0/s1