pyridin-1-ium-1-yl (E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoate

Systemtic Name: pyridin-1-ium-1-yl (E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoate Openeye Name: pyridin-1-ium-1-yl (E)-2-cyano-3-[5-(3-nitrophenyl)-2-furyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[5-(3-nitrophenyl)-2-furanyl]-2-propenoic acid 1-pyridin-1-iumyl ester IUPAC Name: pyridin-1-ium-1-yl (E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[5-(3-nitrophenyl)-2-furyl]acrylic acid pyridin-1-ium-1-yl ester Formula: C19H12N3O5+ MolecularWeight: 362.31568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)OC(=O)C(=CC2=CC=C(O2)C3=CC(=CC=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=[N+](C=C1)OC(=O)/C(=C/C2=CC=C(O2)C3=CC(=CC=C3)[N+](=O)[O-])/C#N

InChI

InChI=1S/C19H12N3O5/c20-13-15(19(23)27-21-9-2-1-3-10-21)12-17-7-8-18(26-17)14-5-4-6-16(11-14)22(24)25/h1-12H/q+1/b15-12+