methyl 5-methyl-3-(nitromethyl)hex-4-enoate

Systemtic Name: methyl 5-methyl-3-(nitromethyl)hex-4-enoate Openeye Name: methyl 5-methyl-3-(nitromethyl)hex-4-enoate CAS Name: 5-methyl-3-(nitromethyl)-4-hexenoic acid methyl ester IUPAC Name: methyl 5-methyl-3-(nitromethyl)hex-4-enoate Traditional Name: 5-methyl-3-(nitromethyl)hex-4-enoic acid methyl ester Formula: C9H15NO4 MolecularWeight: 201.2197

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(CC(=O)OC)C[N+](=O)[O-])C

Isomeric SMILES

CC(=CC(CC(=O)OC)C[N+](=O)[O-])C

InChI

InChI=1S/C9H15NO4/c1-7(2)4-8(6-10(12)13)5-9(11)14-3/h4,8H,5-6H2,1-3H3