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

Systemtic Name: (6-chloranyl-2-oxidanylidene-4-phenyl-chromen-7-yl) 3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Openeye Name: (6-chloro-2-oxo-4-phenyl-chromen-7-yl) 2-(tert-butoxycarbonylamino)-3-methyl-pentanoate CAS Name: 3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid (6-chloro-2-oxo-4-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (6-chloro-2-oxo-4-phenylchromen-7-yl) 3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-methyl-valeric acid (6-chloro-2-keto-4-phenyl-chromen-7-yl) ester Formula: C26H28ClNO6 MolecularWeight: 485.95662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC1=C(C=C2C(=CC(=O)OC2=C1)C3=CC=CC=C3)Cl)NC(=O)OC(C)(C)C

Isomeric SMILES

CCC(C)C(C(=O)OC1=C(C=C2C(=CC(=O)OC2=C1)C3=CC=CC=C3)Cl)NC(=O)OC(C)(C)C

InChI

InChI=1S/C26H28ClNO6/c1-6-15(2)23(28-25(31)34-26(3,4)5)24(30)33-21-14-20-18(12-19(21)27)17(13-22(29)32-20)16-10-8-7-9-11-16/h7-15,23H,6H2,1-5H3,(H,28,31)