3-chloranyl-4-[4-(2-hydroxyethyl)piperazin-1-yl]-1-(3-nitrophenyl)pyrrole-2,5-dione

Systemtic Name: 3-chloranyl-4-[4-(2-hydroxyethyl)piperazin-1-yl]-1-(3-nitrophenyl)pyrrole-2,5-dione Openeye Name: 3-chloro-4-[4-(2-hydroxyethyl)piperazin-1-yl]-1-(3-nitrophenyl)pyrrole-2,5-dione CAS Name: 3-chloro-4-[4-(2-hydroxyethyl)-1-piperazinyl]-1-(3-nitrophenyl)pyrrole-2,5-dione IUPAC Name: 3-chloro-4-[4-(2-hydroxyethyl)piperazin-1-yl]-1-(3-nitrophenyl)pyrrole-2,5-dione Traditional Name: 3-chloro-4-[4-(2-hydroxyethyl)piperazino]-1-(3-nitrophenyl)-3-pyrroline-2,5-quinone Formula: C16H17ClN4O5 MolecularWeight: 380.78298

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C2=C(C(=O)N(C2=O)C3=CC(=CC=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CN(CCN1CCO)C2=C(C(=O)N(C2=O)C3=CC(=CC=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H17ClN4O5/c17-13-14(19-6-4-18(5-7-19)8-9-22)16(24)20(15(13)23)11-2-1-3-12(10-11)21(25)26/h1-3,10,22H,4-9H2