(phenylmethyl) N-[2-[4-(4-iodophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]carbamate

Systemtic Name: (phenylmethyl) N-[2-[4-(4-iodophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]carbamate Openeye Name: benzyl N-[2-[4-(4-iodophenyl)piperazin-1-yl]-2-oxo-ethyl]carbamate CAS Name: N-[2-[4-(4-iodophenyl)-1-piperazinyl]-2-oxoethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-[4-(4-iodophenyl)piperazin-1-yl]-2-oxoethyl]carbamate Traditional Name: N-[2-[4-(4-iodophenyl)piperazino]-2-keto-ethyl]carbamic acid benzyl ester Formula: C20H22IN3O3 MolecularWeight: 479.31145

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)I)C(=O)CNC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)I)C(=O)CNC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H22IN3O3/c21-17-6-8-18(9-7-17)23-10-12-24(13-11-23)19(25)14-22-20(26)27-15-16-4-2-1-3-5-16/h1-9H,10-15H2,(H,22,26)