(phenylmethyl) N-[3-(1H-indol-3-yl)-1-[(4-iodophenyl)amino]-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[3-(1H-indol-3-yl)-1-[(4-iodophenyl)amino]-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: benzyl N-[1-(1H-indol-3-ylmethyl)-2-(4-iodoanilino)-2-oxo-ethyl]carbamate CAS Name: N-[3-(1H-indol-3-yl)-1-(4-iodoanilino)-1-oxopropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-(1H-indol-3-yl)-1-(4-iodoanilino)-1-oxopropan-2-yl]carbamate Traditional Name: N-[1-(1H-indol-3-ylmethyl)-2-(4-iodoanilino)-2-keto-ethyl]carbamic acid benzyl ester Formula: C25H22IN3O3 MolecularWeight: 539.36495

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)NC4=CC=C(C=C4)I

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)NC4=CC=C(C=C4)I

InChI

InChI=1S/C25H22IN3O3/c26-19-10-12-20(13-11-19)28-24(30)23(14-18-15-27-22-9-5-4-8-21(18)22)29-25(31)32-16-17-6-2-1-3-7-17/h1-13,15,23,27H,14,16H2,(H,28,30)(H,29,31)