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

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl 3-(tert-butoxycarbonylamino)propanoate CAS Name: 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 3-(tert-butoxycarbonylamino)propionic acid (7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C20H25NO6 MolecularWeight: 375.4156

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCNC(=O)OC(C)(C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCNC(=O)OC(C)(C)C

InChI

InChI=1S/C20H25NO6/c1-5-13-6-7-15-14(11-18(23)26-16(15)10-13)12-25-17(22)8-9-21-19(24)27-20(2,3)4/h6-7,10-11H,5,8-9,12H2,1-4H3,(H,21,24)