1-methyl-3-nitro-benzene; prop-2-enoate

Systemtic Name: 1-methyl-3-nitro-benzene; prop-2-enoate Openeye Name: 1-methyl-3-nitro-benzene; prop-2-enoate CAS Name: 1-methyl-3-nitrobenzene; 2-propenoate IUPAC Name: 1-methyl-3-nitrobenzene; prop-2-enoate Traditional Name: acrylate; 1-methyl-3-nitro-benzene Formula: C10H10NO4- MolecularWeight: 208.1907

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)[N+](=O)[O-].C=CC(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)[N+](=O)[O-].C=CC(=O)[O-]

InChI

InChI=1S/C7H7NO2.C3H4O2/c1-6-3-2-4-7(5-6)8(9)10;1-2-3(4)5/h2-5H,1H3;2H,1H2,(H,4,5)/p-1