1-(4-chlorophenyl)-2-methoxy-4-nitro-benzene; ethanenitrile

Systemtic Name: 1-(4-chlorophenyl)-2-methoxy-4-nitro-benzene; ethanenitrile Openeye Name: acetonitrile; 1-(4-chlorophenyl)-2-methoxy-4-nitro-benzene CAS Name: acetonitrile; 1-(4-chlorophenyl)-2-methoxy-4-nitrobenzene IUPAC Name: acetonitrile; 1-(4-chlorophenyl)-2-methoxy-4-nitrobenzene Traditional Name: acetonitrile; 1-(4-chlorophenyl)-2-methoxy-4-nitro-benzene Formula: C15H13ClN2O3 MolecularWeight: 304.72832

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Descriptors Computed from Structure

Canonical SMILES:

CC#N.COC1=C(C=CC(=C1)[N+](=O)[O-])C2=CC=C(C=C2)Cl

Isomeric SMILES

CC#N.COC1=C(C=CC(=C1)[N+](=O)[O-])C2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H10ClNO3.C2H3N/c1-18-13-8-11(15(16)17)6-7-12(13)9-2-4-10(14)5-3-9;1-2-3/h2-8H,1H3;1H3