(Z)-3-nitro-3-[1-(pyridin-4-ylmethyl)-5,6-dihydro-4H-pyrimidin-2-yl]prop-2-enoic acid

Systemtic Name: (Z)-3-nitro-3-[1-(pyridin-4-ylmethyl)-5,6-dihydro-4H-pyrimidin-2-yl]prop-2-enoic acid Openeye Name: (Z)-3-nitro-3-[1-(4-pyridylmethyl)-5,6-dihydro-4H-pyrimidin-2-yl]prop-2-enoic acid CAS Name: (Z)-3-nitro-3-[1-(pyridin-4-ylmethyl)-5,6-dihydro-4H-pyrimidin-2-yl]-2-propenoic acid IUPAC Name: (Z)-3-nitro-3-[1-(pyridin-4-ylmethyl)-5,6-dihydro-4H-pyrimidin-2-yl]prop-2-enoic acid Traditional Name: (Z)-3-nitro-3-[1-(4-pyridylmethyl)-5,6-dihydro-4H-pyrimidin-2-yl]acrylic acid Formula: C13H14N4O4 MolecularWeight: 290.27466

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(N(C1)CC2=CC=NC=C2)C(=CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1CN=C(N(C1)CC2=CC=NC=C2)/C(=C/C(=O)O)/[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O4/c18-12(19)8-11(17(20)21)13-15-4-1-7-16(13)9-10-2-5-14-6-3-10/h2-3,5-6,8H,1,4,7,9H2,(H,18,19)/b11-8-