[3-(4-iodanylphenoxy)-4-oxidanylidene-chromen-7-yl] 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoate

Systemtic Name: [3-(4-iodanylphenoxy)-4-oxidanylidene-chromen-7-yl] 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoate Openeye Name: [3-(4-iodophenoxy)-4-oxo-chromen-7-yl] 2-(tert-butoxycarbonylamino)-3-phenyl-propanoate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-phenylpropanoic acid [3-(4-iodophenoxy)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(4-iodophenoxy)-4-oxochromen-7-yl] 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-phenyl-propionic acid [3-(4-iodophenoxy)-4-keto-chromen-7-yl] ester Formula: C29H26INO7 MolecularWeight: 627.42371

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)OC4=CC=C(C=C4)I

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)OC4=CC=C(C=C4)I

InChI

InChI=1S/C29H26INO7/c1-29(2,3)38-28(34)31-23(15-18-7-5-4-6-8-18)27(33)37-21-13-14-22-24(16-21)35-17-25(26(22)32)36-20-11-9-19(30)10-12-20/h4-14,16-17,23H,15H2,1-3H3,(H,31,34)