methyl 6-(4-chlorophenyl)-6-methoxy-4-nitro-hexanoate

Systemtic Name: methyl 6-(4-chlorophenyl)-6-methoxy-4-nitro-hexanoate Openeye Name: methyl 6-(4-chlorophenyl)-6-methoxy-4-nitro-hexanoate CAS Name: 6-(4-chlorophenyl)-6-methoxy-4-nitrohexanoic acid methyl ester IUPAC Name: methyl 6-(4-chlorophenyl)-6-methoxy-4-nitrohexanoate Traditional Name: 6-(4-chlorophenyl)-6-methoxy-4-nitro-hexanoic acid methyl ester Formula: C14H18ClNO5 MolecularWeight: 315.74942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(CC(CCC(=O)OC)[N+](=O)[O-])C1=CC=C(C=C1)Cl

Isomeric SMILES

COC(CC(CCC(=O)OC)[N+](=O)[O-])C1=CC=C(C=C1)Cl

InChI

InChI=1S/C14H18ClNO5/c1-20-13(10-3-5-11(15)6-4-10)9-12(16(18)19)7-8-14(17)21-2/h3-6,12-13H,7-9H2,1-2H3