1-[4-(4-iodophenyl)-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone

Systemtic Name: 1-[4-(4-iodophenyl)-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone Openeye Name: 1-[4-(4-iodophenyl)-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone CAS Name: 1-[4-(4-iodophenyl)-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone IUPAC Name: 1-[4-(4-iodophenyl)-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone Traditional Name: 1-[4-(4-iodophenyl)-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone Formula: C24H21IN2O2 MolecularWeight: 496.34021

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)I)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(=O)N1C(CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)I)C4=CC=C(C=C4)OC

InChI

InChI=1S/C24H21IN2O2/c1-16(28)27-23-6-4-3-5-21(23)26-22(17-7-11-19(25)12-8-17)15-24(27)18-9-13-20(29-2)14-10-18/h3-14,24H,15H2,1-2H3