(4-heptylphenyl) 5-(4-propylphenyl)pyrazine-2-carboxylate

Systemtic Name: (4-heptylphenyl) 5-(4-propylphenyl)pyrazine-2-carboxylate Openeye Name: (4-heptylphenyl) 5-(4-propylphenyl)pyrazine-2-carboxylate CAS Name: 5-(4-propylphenyl)-2-pyrazinecarboxylic acid (4-heptylphenyl) ester IUPAC Name: (4-heptylphenyl) 5-(4-propylphenyl)pyrazine-2-carboxylate Traditional Name: 5-(4-propylphenyl)pyrazinic acid (4-heptylphenyl) ester Formula: C27H32N2O2 MolecularWeight: 416.55518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)OC(=O)C2=NC=C(N=C2)C3=CC=C(C=C3)CCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)OC(=O)C2=NC=C(N=C2)C3=CC=C(C=C3)CCC

InChI

InChI=1S/C27H32N2O2/c1-3-5-6-7-8-10-22-13-17-24(18-14-22)31-27(30)26-20-28-25(19-29-26)23-15-11-21(9-4-2)12-16-23/h11-20H,3-10H2,1-2H3