(3,4,7-trimethyl-2-oxidanylidene-chromen-5-yl) (2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: (3,4,7-trimethyl-2-oxidanylidene-chromen-5-yl) (2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoate Openeye Name: (3,4,7-trimethyl-2-oxo-chromen-5-yl) (2S)-2-(benzyloxycarbonylamino)-4-methyl-pentanoate CAS Name: (2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoic acid (3,4,7-trimethyl-2-oxo-1-benzopyran-5-yl) ester IUPAC Name: (3,4,7-trimethyl-2-oxochromen-5-yl) (2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-4-methyl-valeric acid (2-keto-3,4,7-trimethyl-chromen-5-yl) ester Formula: C26H29NO6 MolecularWeight: 451.51156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)C)C)C(=C1)OC(=O)C(CC(C)C)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)C)C)C(=C1)OC(=O)[C@H](CC(C)C)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H29NO6/c1-15(2)11-20(27-26(30)31-14-19-9-7-6-8-10-19)25(29)33-22-13-16(3)12-21-23(22)17(4)18(5)24(28)32-21/h6-10,12-13,15,20H,11,14H2,1-5H3,(H,27,30)/t20-/m0/s1