(E)-3-(3-nitro-4-pyrrolidin-1-yl-phenyl)prop-2-enoate

Systemtic Name: (E)-3-(3-nitro-4-pyrrolidin-1-yl-phenyl)prop-2-enoate Openeye Name: (E)-3-(3-nitro-4-pyrrolidin-1-yl-phenyl)prop-2-enoate CAS Name: (E)-3-[3-nitro-4-(1-pyrrolidinyl)phenyl]-2-propenoate IUPAC Name: (E)-3-(3-nitro-4-pyrrolidin-1-ylphenyl)prop-2-enoate Traditional Name: (E)-3-(3-nitro-4-pyrrolidino-phenyl)acrylate Formula: C13H13N2O4- MolecularWeight: 261.25332

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C=CC(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)/C=C/C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O4/c16-13(17)6-4-10-3-5-11(12(9-10)15(18)19)14-7-1-2-8-14/h3-6,9H,1-2,7-8H2,(H,16,17)/p-1/b6-4+