2-[4-(4-chloranyl-2-nitro-phenoxy)butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-(4-chloranyl-2-nitro-phenoxy)butyl]isoindole-1,3-dione Openeye Name: 2-[4-(4-chloro-2-nitro-phenoxy)butyl]isoindoline-1,3-dione CAS Name: 2-[4-(4-chloro-2-nitrophenoxy)butyl]isoindole-1,3-dione IUPAC Name: 2-[4-(4-chloro-2-nitrophenoxy)butyl]isoindole-1,3-dione Traditional Name: 2-[4-(4-chloro-2-nitro-phenoxy)butyl]isoindoline-1,3-quinone Formula: C18H15ClN2O5 MolecularWeight: 374.7751

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCOC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCOC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H15ClN2O5/c19-12-7-8-16(15(11-12)21(24)25)26-10-4-3-9-20-17(22)13-5-1-2-6-14(13)18(20)23/h1-2,5-8,11H,3-4,9-10H2