2-[3-(4-chloranylphenoxy)propyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[3-(4-chloranylphenoxy)propyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[3-(4-chlorophenoxy)propyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[3-(4-chlorophenoxy)propyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[3-(4-chlorophenoxy)propyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[3-(4-chlorophenoxy)propyl]-5-nitro-isoindoline-1,3-quinone Formula: C17H13ClN2O5 MolecularWeight: 360.74852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCCN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1OCCCN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H13ClN2O5/c18-11-2-5-13(6-3-11)25-9-1-8-19-16(21)14-7-4-12(20(23)24)10-15(14)17(19)22/h2-7,10H,1,8-9H2