(2-azanyl-5-chloranyl-3-iodanyl-phenyl)-(4-tert-butylpiperazin-1-yl)methanone

Systemtic Name: (2-azanyl-5-chloranyl-3-iodanyl-phenyl)-(4-tert-butylpiperazin-1-yl)methanone Openeye Name: (2-amino-5-chloro-3-iodo-phenyl)-(4-tert-butylpiperazin-1-yl)methanone CAS Name: (2-amino-5-chloro-3-iodophenyl)-(4-tert-butyl-1-piperazinyl)methanone IUPAC Name: (2-amino-5-chloro-3-iodophenyl)-(4-tert-butylpiperazin-1-yl)methanone Traditional Name: (2-amino-5-chloro-3-iodo-phenyl)-(4-tert-butylpiperazino)methanone Formula: C15H21ClIN3O MolecularWeight: 421.70421

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CCN(CC1)C(=O)C2=CC(=CC(=C2N)I)Cl

Isomeric SMILES

CC(C)(C)N1CCN(CC1)C(=O)C2=CC(=CC(=C2N)I)Cl

InChI

InChI=1S/C15H21ClIN3O/c1-15(2,3)20-6-4-19(5-7-20)14(21)11-8-10(16)9-12(17)13(11)18/h8-9H,4-7,18H2,1-3H3