[(E)-but-2-enyl] 3-methyl-4-(4-nitrophenoxy)pentanoate

Systemtic Name: [(E)-but-2-enyl] 3-methyl-4-(4-nitrophenoxy)pentanoate Openeye Name: [(E)-but-2-enyl] 3-methyl-4-(4-nitrophenoxy)pentanoate CAS Name: 3-methyl-4-(4-nitrophenoxy)pentanoic acid [(E)-but-2-enyl] ester IUPAC Name: [(E)-but-2-enyl] 3-methyl-4-(4-nitrophenoxy)pentanoate Traditional Name: 3-methyl-4-(4-nitrophenoxy)valeric acid [(E)-but-2-enyl] ester Formula: C16H21NO5 MolecularWeight: 307.34164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CCOC(=O)CC(C)C(C)OC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

C/C=C/COC(=O)CC(C)C(C)OC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C16H21NO5/c1-4-5-10-21-16(18)11-12(2)13(3)22-15-8-6-14(7-9-15)17(19)20/h4-9,12-13H,10-11H2,1-3H3/b5-4+