5-nitro-2-[(E)-2-(4-propan-2-yloxyphenyl)ethenyl]pyridine-3-carboxylic acid

Systemtic Name: 5-nitro-2-[(E)-2-(4-propan-2-yloxyphenyl)ethenyl]pyridine-3-carboxylic acid Openeye Name: 2-[(E)-2-(4-isopropoxyphenyl)vinyl]-5-nitro-pyridine-3-carboxylic acid CAS Name: 5-nitro-2-[(E)-2-(4-propan-2-yloxyphenyl)ethenyl]-3-pyridinecarboxylic acid IUPAC Name: 5-nitro-2-[(E)-2-(4-propan-2-yloxyphenyl)ethenyl]pyridine-3-carboxylic acid Traditional Name: 2-[(E)-2-(4-isopropoxyphenyl)vinyl]-5-nitro-nicotinic acid Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C=CC2=NC=C(C=C2C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)/C=C/C2=NC=C(C=C2C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O5/c1-11(2)24-14-6-3-12(4-7-14)5-8-16-15(17(20)21)9-13(10-18-16)19(22)23/h3-11H,1-2H3,(H,20,21)/b8-5+