2-(8-iodanyl-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)ethanamine

Systemtic Name: 2-(8-iodanyl-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)ethanamine Openeye Name: 2-(8-iodo-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)ethanamine CAS Name: 2-(8-iodo-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)ethanamine IUPAC Name: 2-(8-iodo-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)ethanamine Traditional Name: 2-(8-iodo-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)ethylamine Formula: C18H20IN3 MolecularWeight: 405.27597

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(CN=C(C2=C1C=C(C=C2)I)C3=CC=CC=C3)CCN

Isomeric SMILES

CN1C(CN=C(C2=C1C=C(C=C2)I)C3=CC=CC=C3)CCN

InChI

InChI=1S/C18H20IN3/c1-22-15(9-10-20)12-21-18(13-5-3-2-4-6-13)16-8-7-14(19)11-17(16)22/h2-8,11,15H,9-10,12,20H2,1H3