[3-(3-methoxyphenoxy)-4-oxidanylidene-chromen-7-yl] (2R)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate

Systemtic Name: [3-(3-methoxyphenoxy)-4-oxidanylidene-chromen-7-yl] (2R)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Openeye Name: [3-(3-methoxyphenoxy)-4-oxo-chromen-7-yl] (2R)-2-(tert-butoxycarbonylamino)-4-methyl-pentanoate CAS Name: (2R)-4-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid [3-(3-methoxyphenoxy)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(3-methoxyphenoxy)-4-oxochromen-7-yl] (2R)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Traditional Name: (2R)-2-(tert-butoxycarbonylamino)-4-methyl-valeric acid [4-keto-3-(3-methoxyphenoxy)chromen-7-yl] ester Formula: C27H31NO8 MolecularWeight: 497.53694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC(=CC=C3)OC)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C[C@H](C(=O)OC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC(=CC=C3)OC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C27H31NO8/c1-16(2)12-21(28-26(31)36-27(3,4)5)25(30)35-19-10-11-20-22(14-19)33-15-23(24(20)29)34-18-9-7-8-17(13-18)32-6/h7-11,13-16,21H,12H2,1-6H3,(H,28,31)/t21-/m1/s1