[4,7-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-5-yl] 2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate

Systemtic Name: [4,7-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-5-yl] 2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Openeye Name: (3-benzyl-4,7-dimethyl-2-oxo-chromen-5-yl) 2-(tert-butoxycarbonylamino)pentanoate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid [4,7-dimethyl-2-oxo-3-(phenylmethyl)-1-benzopyran-5-yl] ester IUPAC Name: (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Traditional Name: 2-(tert-butoxycarbonylamino)valeric acid (3-benzyl-2-keto-4,7-dimethyl-chromen-5-yl) ester Formula: C28H33NO6 MolecularWeight: 479.56472

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OC1=CC(=CC2=C1C(=C(C(=O)O2)CC3=CC=CC=C3)C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCC(C(=O)OC1=CC(=CC2=C1C(=C(C(=O)O2)CC3=CC=CC=C3)C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C28H33NO6/c1-7-11-21(29-27(32)35-28(4,5)6)26(31)34-23-15-17(2)14-22-24(23)18(3)20(25(30)33-22)16-19-12-9-8-10-13-19/h8-10,12-15,21H,7,11,16H2,1-6H3,(H,29,32)