[4-(2-methylbutoxy)-2-pyrazin-2-yl-phenyl] 4-nonoxybenzoate

Systemtic Name: [4-(2-methylbutoxy)-2-pyrazin-2-yl-phenyl] 4-nonoxybenzoate Openeye Name: [4-(2-methylbutoxy)-2-pyrazin-2-yl-phenyl] 4-nonoxybenzoate CAS Name: 4-nonoxybenzoic acid [4-(2-methylbutoxy)-2-(2-pyrazinyl)phenyl] ester IUPAC Name: [4-(2-methylbutoxy)-2-pyrazin-2-ylphenyl] 4-nonoxybenzoate Traditional Name: 4-nonoxybenzoic acid [4-(2-methylbutoxy)-2-pyrazin-2-yl-phenyl] ester Formula: C31H40N2O4 MolecularWeight: 504.6603

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)OCC(C)CC)C3=NC=CN=C3

Isomeric SMILES

CCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)OCC(C)CC)C3=NC=CN=C3

InChI

InChI=1S/C31H40N2O4/c1-4-6-7-8-9-10-11-20-35-26-14-12-25(13-15-26)31(34)37-30-17-16-27(36-23-24(3)5-2)21-28(30)29-22-32-18-19-33-29/h12-19,21-22,24H,4-11,20,23H2,1-3H3