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

Systemtic Name: [4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl] 2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Openeye Name: (3-benzyl-4-methyl-2-oxo-chromen-7-yl) 2-(tert-butoxycarbonylamino)pentanoate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid [4-methyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-yl] ester IUPAC Name: (3-benzyl-4-methyl-2-oxochromen-7-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Traditional Name: 2-(tert-butoxycarbonylamino)valeric acid (3-benzyl-2-keto-4-methyl-chromen-7-yl) ester Formula: C27H31NO6 MolecularWeight: 465.53814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OC1=CC2=C(C=C1)C(=C(C(=O)O2)CC3=CC=CC=C3)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCC(C(=O)OC1=CC2=C(C=C1)C(=C(C(=O)O2)CC3=CC=CC=C3)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C27H31NO6/c1-6-10-22(28-26(31)34-27(3,4)5)25(30)32-19-13-14-20-17(2)21(24(29)33-23(20)16-19)15-18-11-8-7-9-12-18/h7-9,11-14,16,22H,6,10,15H2,1-5H3,(H,28,31)