methyl (E)-3-benzamido-3-nitro-2-pyrrolidin-1-yl-prop-2-enoate

Systemtic Name: methyl (E)-3-benzamido-3-nitro-2-pyrrolidin-1-yl-prop-2-enoate Openeye Name: methyl (E)-3-benzamido-3-nitro-2-pyrrolidin-1-yl-prop-2-enoate CAS Name: (E)-3-benzamido-3-nitro-2-(1-pyrrolidinyl)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-benzamido-3-nitro-2-pyrrolidin-1-ylprop-2-enoate Traditional Name: (E)-3-benzamido-3-nitro-2-pyrrolidino-acrylic acid methyl ester Formula: C15H17N3O5 MolecularWeight: 319.31258

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C(NC(=O)C1=CC=CC=C1)[N+](=O)[O-])N2CCCC2

Isomeric SMILES

COC(=O)/C(=C(/NC(=O)C1=CC=CC=C1)\[N+](=O)[O-])/N2CCCC2

InChI

InChI=1S/C15H17N3O5/c1-23-15(20)12(17-9-5-6-10-17)13(18(21)22)16-14(19)11-7-3-2-4-8-11/h2-4,7-8H,5-6,9-10H2,1H3,(H,16,19)/b13-12+