methyl 6-[(E)-2-(3-nitro-4-propan-2-yl-phenyl)ethenyl]pyridine-3-carboxylate

Systemtic Name: methyl 6-[(E)-2-(3-nitro-4-propan-2-yl-phenyl)ethenyl]pyridine-3-carboxylate Openeye Name: methyl 6-[(E)-2-(4-isopropyl-3-nitro-phenyl)vinyl]pyridine-3-carboxylate CAS Name: 6-[(E)-2-(3-nitro-4-propan-2-ylphenyl)ethenyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[(E)-2-(3-nitro-4-propan-2-ylphenyl)ethenyl]pyridine-3-carboxylate Traditional Name: 6-[(E)-2-(4-isopropyl-3-nitro-phenyl)vinyl]nicotinic acid methyl ester Formula: C18H18N2O4 MolecularWeight: 326.34652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O4/c1-12(2)16-9-5-13(10-17(16)20(22)23)4-7-15-8-6-14(11-19-15)18(21)24-3/h4-12H,1-3H3/b7-4+