3-chloranyl-4-(4-ethylpiperazin-1-yl)-1-(4-iodanyl-2-methyl-phenyl)pyrrole-2,5-dione

Systemtic Name: 3-chloranyl-4-(4-ethylpiperazin-1-yl)-1-(4-iodanyl-2-methyl-phenyl)pyrrole-2,5-dione Openeye Name: 3-chloro-4-(4-ethylpiperazin-1-yl)-1-(4-iodo-2-methyl-phenyl)pyrrole-2,5-dione CAS Name: 3-chloro-4-(4-ethyl-1-piperazinyl)-1-(4-iodo-2-methylphenyl)pyrrole-2,5-dione IUPAC Name: 3-chloro-4-(4-ethylpiperazin-1-yl)-1-(4-iodo-2-methylphenyl)pyrrole-2,5-dione Traditional Name: 3-chloro-4-(4-ethylpiperazino)-1-(4-iodo-2-methyl-phenyl)-3-pyrroline-2,5-quinone Formula: C17H19ClIN3O2 MolecularWeight: 459.70913

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C(=O)N(C2=O)C3=C(C=C(C=C3)I)C)Cl

Isomeric SMILES

CCN1CCN(CC1)C2=C(C(=O)N(C2=O)C3=C(C=C(C=C3)I)C)Cl

InChI

InChI=1S/C17H19ClIN3O2/c1-3-20-6-8-21(9-7-20)15-14(18)16(23)22(17(15)24)13-5-4-12(19)10-11(13)2/h4-5,10H,3,6-9H2,1-2H3