tert-butyl N-[1-(ethoxymethyl)indol-2-yl]carbonyl-N-[2-(2-iodanylphenyl)ethyl]carbamate

Systemtic Name: tert-butyl N-[1-(ethoxymethyl)indol-2-yl]carbonyl-N-[2-(2-iodanylphenyl)ethyl]carbamate Openeye Name: tert-butyl N-[1-(ethoxymethyl)indole-2-carbonyl]-N-[2-(2-iodophenyl)ethyl]carbamate CAS Name: N-[[1-(ethoxymethyl)-2-indolyl]-oxomethyl]-N-[2-(2-iodophenyl)ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(ethoxymethyl)indole-2-carbonyl]-N-[2-(2-iodophenyl)ethyl]carbamate Traditional Name: N-[1-(ethoxymethyl)indole-2-carbonyl]-N-[2-(2-iodophenyl)ethyl]carbamic acid tert-butyl ester Formula: C25H29IN2O4 MolecularWeight: 548.41323

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Descriptors Computed from Structure

Canonical SMILES:

CCOCN1C2=CC=CC=C2C=C1C(=O)N(CCC3=CC=CC=C3I)C(=O)OC(C)(C)C

Isomeric SMILES

CCOCN1C2=CC=CC=C2C=C1C(=O)N(CCC3=CC=CC=C3I)C(=O)OC(C)(C)C

InChI

InChI=1S/C25H29IN2O4/c1-5-31-17-28-21-13-9-7-11-19(21)16-22(28)23(29)27(24(30)32-25(2,3)4)15-14-18-10-6-8-12-20(18)26/h6-13,16H,5,14-15,17H2,1-4H3