[3,6-bis(chloranyl)-4-methyl-2-oxidanylidene-chromen-7-yl] (2R)-2-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: [3,6-bis(chloranyl)-4-methyl-2-oxidanylidene-chromen-7-yl] (2R)-2-(phenylmethoxycarbonylamino)pentanoate Openeye Name: (3,6-dichloro-4-methyl-2-oxo-chromen-7-yl) (2R)-2-(benzyloxycarbonylamino)pentanoate CAS Name: (2R)-2-(phenylmethoxycarbonylamino)pentanoic acid (3,6-dichloro-4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (3,6-dichloro-4-methyl-2-oxochromen-7-yl) (2R)-2-(phenylmethoxycarbonylamino)pentanoate Traditional Name: (2R)-2-(benzyloxycarbonylamino)valeric acid (3,6-dichloro-2-keto-4-methyl-chromen-7-yl) ester Formula: C23H21Cl2NO6 MolecularWeight: 478.32194

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OC1=C(C=C2C(=C(C(=O)OC2=C1)Cl)C)Cl)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCC[C@H](C(=O)OC1=C(C=C2C(=C(C(=O)OC2=C1)Cl)C)Cl)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H21Cl2NO6/c1-3-7-17(26-23(29)30-12-14-8-5-4-6-9-14)21(27)32-19-11-18-15(10-16(19)24)13(2)20(25)22(28)31-18/h4-6,8-11,17H,3,7,12H2,1-2H3,(H,26,29)/t17-/m1/s1