methyl 4-methyl-2-(2-nitroethylamino)pentanoate

Systemtic Name: methyl 4-methyl-2-(2-nitroethylamino)pentanoate Openeye Name: methyl 4-methyl-2-(2-nitroethylamino)pentanoate CAS Name: 4-methyl-2-(2-nitroethylamino)pentanoic acid methyl ester IUPAC Name: methyl 4-methyl-2-(2-nitroethylamino)pentanoate Traditional Name: 4-methyl-2-(2-nitroethylamino)valeric acid methyl ester Formula: C9H18N2O4 MolecularWeight: 218.25022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H18N2O4/c1-7(2)6-8(9(12)15-3)10-4-5-11(13)14/h7-8,10H,4-6H2,1-3H3