(6-methyl-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) 2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: (6-methyl-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) 2-(phenylmethoxycarbonylamino)butanoate Openeye Name: (6-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) 2-(benzyloxycarbonylamino)butanoate CAS Name: 2-(phenylmethoxycarbonylamino)butanoic acid (6-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-7-yl) ester IUPAC Name: (6-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) 2-(phenylmethoxycarbonylamino)butanoate Traditional Name: 2-(benzyloxycarbonylamino)butyric acid (4-keto-6-methyl-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) ester Formula: C25H25NO6 MolecularWeight: 435.4691

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC1=C(C2=C(C=C1)C3=C(CCC3)C(=O)O2)C)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)OC1=C(C2=C(C=C1)C3=C(CCC3)C(=O)O2)C)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H25NO6/c1-3-20(26-25(29)30-14-16-8-5-4-6-9-16)24(28)31-21-13-12-18-17-10-7-11-19(17)23(27)32-22(18)15(21)2/h4-6,8-9,12-13,20H,3,7,10-11,14H2,1-2H3,(H,26,29)