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

Systemtic Name: [4,7-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-5-yl] 4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Openeye Name: (3-benzyl-4,7-dimethyl-2-oxo-chromen-5-yl) 4-(tert-butoxycarbonylamino)butanoate CAS Name: 4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid [4,7-dimethyl-2-oxo-3-(phenylmethyl)-1-benzopyran-5-yl] ester IUPAC Name: (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) 4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Traditional Name: 4-(tert-butoxycarbonylamino)butyric acid (3-benzyl-2-keto-4,7-dimethyl-chromen-5-yl) ester Formula: C27H31NO6 MolecularWeight: 465.53814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OC(=O)CCCNC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OC(=O)CCCNC(=O)OC(C)(C)C

InChI

InChI=1S/C27H31NO6/c1-17-14-21(32-23(29)12-9-13-28-26(31)34-27(3,4)5)24-18(2)20(25(30)33-22(24)15-17)16-19-10-7-6-8-11-19/h6-8,10-11,14-15H,9,12-13,16H2,1-5H3,(H,28,31)