tert-butyl 4-iodanyl-5-[(2-methylpropan-2-yl)oxycarbonyl-(phenylcarbonyl)amino]-7-phenylmethoxy-indole-1-carboxylate

Systemtic Name: tert-butyl 4-iodanyl-5-[(2-methylpropan-2-yl)oxycarbonyl-(phenylcarbonyl)amino]-7-phenylmethoxy-indole-1-carboxylate Openeye Name: tert-butyl 5-[benzoyl(tert-butoxycarbonyl)amino]-7-benzyloxy-4-iodo-indole-1-carboxylate CAS Name: 5-[benzoyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-iodo-7-phenylmethoxy-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-[benzoyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-iodo-7-phenylmethoxyindole-1-carboxylate Traditional Name: 7-benzoxy-5-[benzoyl(tert-butoxycarbonyl)amino]-4-iodo-indole-1-carboxylic acid tert-butyl ester Formula: C32H33IN2O6 MolecularWeight: 668.51869

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=CC2=C(C(=CC(=C21)OCC3=CC=CC=C3)N(C(=O)C4=CC=CC=C4)C(=O)OC(C)(C)C)I

Isomeric SMILES

CC(C)(C)OC(=O)N1C=CC2=C(C(=CC(=C21)OCC3=CC=CC=C3)N(C(=O)C4=CC=CC=C4)C(=O)OC(C)(C)C)I

InChI

InChI=1S/C32H33IN2O6/c1-31(2,3)40-29(37)34-18-17-23-26(33)24(19-25(27(23)34)39-20-21-13-9-7-10-14-21)35(30(38)41-32(4,5)6)28(36)22-15-11-8-12-16-22/h7-19H,20H2,1-6H3