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

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl 3-(tert-butoxycarbonylamino)propanoate CAS Name: 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 3-(tert-butoxycarbonylamino)propionic acid (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C19H22ClNO6 MolecularWeight: 395.83408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CCNC(=O)OC(C)(C)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CCNC(=O)OC(C)(C)C)Cl

InChI

InChI=1S/C19H22ClNO6/c1-11-7-15-13(9-14(11)20)12(8-17(23)26-15)10-25-16(22)5-6-21-18(24)27-19(2,3)4/h7-9H,5-6,10H2,1-4H3,(H,21,24)