1-[1-(3-butylphenyl)-2H-pyrazin-5-yl]propan-2-yl butanoate

Systemtic Name: 1-[1-(3-butylphenyl)-2H-pyrazin-5-yl]propan-2-yl butanoate Openeye Name: [2-[1-(3-butylphenyl)-2H-pyrazin-5-yl]-1-methyl-ethyl] butanoate CAS Name: butanoic acid 1-[1-(3-butylphenyl)-2H-pyrazin-5-yl]propan-2-yl ester IUPAC Name: 1-[1-(3-butylphenyl)-2H-pyrazin-5-yl]propan-2-yl butanoate Traditional Name: butyric acid [2-[1-(3-butylphenyl)-2H-pyrazin-5-yl]-1-methyl-ethyl] ester Formula: C21H30N2O2 MolecularWeight: 342.4751

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=CC=C1)N2CC=NC(=C2)CC(C)OC(=O)CCC

Isomeric SMILES

CCCCC1=CC(=CC=C1)N2CC=NC(=C2)CC(C)OC(=O)CCC

InChI

InChI=1S/C21H30N2O2/c1-4-6-9-18-10-7-11-20(15-18)23-13-12-22-19(16-23)14-17(3)25-21(24)8-5-2/h7,10-12,15-17H,4-6,8-9,13-14H2,1-3H3