(4-butyl-6-chloranyl-2-oxidanylidene-chromen-7-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenyl-ethanoate

Systemtic Name: (4-butyl-6-chloranyl-2-oxidanylidene-chromen-7-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenyl-ethanoate Openeye Name: (4-butyl-6-chloro-2-oxo-chromen-7-yl) 2-(tert-butoxycarbonylamino)-2-phenyl-acetate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-phenylacetic acid (4-butyl-6-chloro-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-butyl-6-chloro-2-oxochromen-7-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylacetate Traditional Name: 2-(tert-butoxycarbonylamino)-2-phenyl-acetic acid (4-butyl-6-chloro-2-keto-chromen-7-yl) ester Formula: C26H28ClNO6 MolecularWeight: 485.95662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C(C3=CC=CC=C3)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C(C3=CC=CC=C3)NC(=O)OC(C)(C)C

InChI

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