(E)-4-[2-(4-chloranylpentoxy)phenyl]-3-nitro-but-3-en-2-one

Systemtic Name: (E)-4-[2-(4-chloranylpentoxy)phenyl]-3-nitro-but-3-en-2-one Openeye Name: (E)-4-[2-(4-chloropentoxy)phenyl]-3-nitro-but-3-en-2-one CAS Name: (E)-4-[2-(4-chloropentoxy)phenyl]-3-nitro-3-buten-2-one IUPAC Name: (E)-4-[2-(4-chloropentoxy)phenyl]-3-nitrobut-3-en-2-one Traditional Name: (E)-4-[2-(4-chloropentoxy)phenyl]-3-nitro-but-3-en-2-one Formula: C15H18ClNO4 MolecularWeight: 311.76072

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCOC1=CC=CC=C1C=C(C(=O)C)[N+](=O)[O-])Cl

Isomeric SMILES

CC(CCCOC1=CC=CC=C1/C=C(\C(=O)C)/[N+](=O)[O-])Cl

InChI

InChI=1S/C15H18ClNO4/c1-11(16)6-5-9-21-15-8-4-3-7-13(15)10-14(12(2)18)17(19)20/h3-4,7-8,10-11H,5-6,9H2,1-2H3/b14-10+