2-[2-[3-(3-propylphenyl)pyrazin-2-yl]ethyl]pentanoate

Systemtic Name: 2-[2-[3-(3-propylphenyl)pyrazin-2-yl]ethyl]pentanoate Openeye Name: 2-[2-[3-(3-propylphenyl)pyrazin-2-yl]ethyl]pentanoate CAS Name: 2-[2-[3-(3-propylphenyl)-2-pyrazinyl]ethyl]pentanoate IUPAC Name: 2-[2-[3-(3-propylphenyl)pyrazin-2-yl]ethyl]pentanoate Traditional Name: 2-[2-[3-(3-propylphenyl)pyrazin-2-yl]ethyl]valerate Formula: C20H25N2O2- MolecularWeight: 325.4247

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC(=C1)C2=NC=CN=C2CCC(CCC)C(=O)[O-]

Isomeric SMILES

CCCC1=CC=CC(=C1)C2=NC=CN=C2CCC(CCC)C(=O)[O-]

InChI

InChI=1S/C20H26N2O2/c1-3-6-15-8-5-9-17(14-15)19-18(21-12-13-22-19)11-10-16(7-4-2)20(23)24/h5,8-9,12-14,16H,3-4,6-7,10-11H2,1-2H3,(H,23,24)/p-1