2-(3-nitrophenyl)-1-oxidanidyl-6-[(E)-2-(4-propoxyphenyl)ethenyl]pyrimidin-1-ium

Systemtic Name: 2-(3-nitrophenyl)-1-oxidanidyl-6-[(E)-2-(4-propoxyphenyl)ethenyl]pyrimidin-1-ium Openeye Name: 2-(3-nitrophenyl)-1-oxido-6-[(E)-2-(4-propoxyphenyl)vinyl]pyrimidin-1-ium CAS Name: 2-(3-nitrophenyl)-1-oxido-6-[(E)-2-(4-propoxyphenyl)ethenyl]pyrimidin-1-ium IUPAC Name: 2-(3-nitrophenyl)-1-oxido-6-[(E)-2-(4-propoxyphenyl)ethenyl]pyrimidin-1-ium Traditional Name: 2-(3-nitrophenyl)-1-oxido-6-[(E)-2-(4-propoxyphenyl)vinyl]pyrimidin-1-ium Formula: C21H19N3O4 MolecularWeight: 377.39326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C=CC2=[N+](C(=NC=C2)C3=CC(=CC=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

CCCOC1=CC=C(C=C1)/C=C/C2=[N+](C(=NC=C2)C3=CC(=CC=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C21H19N3O4/c1-2-14-28-20-10-7-16(8-11-20)6-9-18-12-13-22-21(23(18)25)17-4-3-5-19(15-17)24(26)27/h3-13,15H,2,14H2,1H3/b9-6+