tert-butyl N-[4-iodanyl-1-(phenylcarbonyl)-7-phenylmethoxy-indol-5-yl]carbamate

Systemtic Name: tert-butyl N-[4-iodanyl-1-(phenylcarbonyl)-7-phenylmethoxy-indol-5-yl]carbamate Openeye Name: tert-butyl N-(1-benzoyl-7-benzyloxy-4-iodo-indol-5-yl)carbamate CAS Name: N-(1-benzoyl-4-iodo-7-phenylmethoxy-5-indolyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(1-benzoyl-4-iodo-7-phenylmethoxyindol-5-yl)carbamate Traditional Name: N-(7-benzoxy-1-benzoyl-4-iodo-indol-5-yl)carbamic acid tert-butyl ester Formula: C27H25IN2O4 MolecularWeight: 568.40287

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC(=C2C(=C1I)C=CN2C(=O)C3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC(=C2C(=C1I)C=CN2C(=O)C3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H25IN2O4/c1-27(2,3)34-26(32)29-21-16-22(33-17-18-10-6-4-7-11-18)24-20(23(21)28)14-15-30(24)25(31)19-12-8-5-9-13-19/h4-16H,17H2,1-3H3,(H,29,32)