(4-butoxycarbonylphenyl) pyridine-4-carboxylate

Systemtic Name: (4-butoxycarbonylphenyl) pyridine-4-carboxylate Openeye Name: (4-butoxycarbonylphenyl) pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [4-[butoxy(oxo)methyl]phenyl] ester IUPAC Name: (4-butoxycarbonylphenyl) pyridine-4-carboxylate Traditional Name: isonicotinic acid (4-butoxycarbonylphenyl) ester Formula: C17H17NO4 MolecularWeight: 299.32118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=NC=C2

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=NC=C2

InChI

InChI=1S/C17H17NO4/c1-2-3-12-21-16(19)13-4-6-15(7-5-13)22-17(20)14-8-10-18-11-9-14/h4-11H,2-3,12H2,1H3