2-[2-[3-(3-butoxyphenyl)pyrazin-2-yl]ethyl]pentanoic acid

Systemtic Name: 2-[2-[3-(3-butoxyphenyl)pyrazin-2-yl]ethyl]pentanoic acid Openeye Name: 2-[2-[3-(3-butoxyphenyl)pyrazin-2-yl]ethyl]pentanoic acid CAS Name: 2-[2-[3-(3-butoxyphenyl)-2-pyrazinyl]ethyl]pentanoic acid IUPAC Name: 2-[2-[3-(3-butoxyphenyl)pyrazin-2-yl]ethyl]pentanoic acid Traditional Name: 2-[2-[3-(3-butoxyphenyl)pyrazin-2-yl]ethyl]valeric acid Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2=NC=CN=C2CCC(CCC)C(=O)O

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C2=NC=CN=C2CCC(CCC)C(=O)O

InChI

InChI=1S/C21H28N2O3/c1-3-5-14-26-18-9-6-8-17(15-18)20-19(22-12-13-23-20)11-10-16(7-4-2)21(24)25/h6,8-9,12-13,15-16H,3-5,7,10-11,14H2,1-2H3,(H,24,25)