[3,6-bis(chloranyl)-4-methyl-2-oxidanylidene-chromen-7-yl] 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: [3,6-bis(chloranyl)-4-methyl-2-oxidanylidene-chromen-7-yl] 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: (3,6-dichloro-4-methyl-2-oxo-chromen-7-yl) 3-(tert-butoxycarbonylamino)propanoate CAS Name: 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid (3,6-dichloro-4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (3,6-dichloro-4-methyl-2-oxochromen-7-yl) 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 3-(tert-butoxycarbonylamino)propionic acid (3,6-dichloro-2-keto-4-methyl-chromen-7-yl) ester Formula: C18H19Cl2NO6 MolecularWeight: 416.25256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OC(=O)CCNC(=O)OC(C)(C)C)Cl

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OC(=O)CCNC(=O)OC(C)(C)C)Cl

InChI

InChI=1S/C18H19Cl2NO6/c1-9-10-7-11(19)13(8-12(10)26-16(23)15(9)20)25-14(22)5-6-21-17(24)27-18(2,3)4/h7-8H,5-6H2,1-4H3,(H,21,24)