[3-[3-(2-methylbutoxy)phenyl]pyrazin-2-yl] 4-nonoxycarbonyloxybenzoate

Systemtic Name: [3-[3-(2-methylbutoxy)phenyl]pyrazin-2-yl] 4-nonoxycarbonyloxybenzoate Openeye Name: [3-[3-(2-methylbutoxy)phenyl]pyrazin-2-yl] 4-nonoxycarbonyloxybenzoate CAS Name: 4-[nonoxy(oxo)methoxy]benzoic acid [3-[3-(2-methylbutoxy)phenyl]-2-pyrazinyl] ester IUPAC Name: [3-[3-(2-methylbutoxy)phenyl]pyrazin-2-yl] 4-nonoxycarbonyloxybenzoate Traditional Name: 4-nonoxycarbonyloxybenzoic acid [3-[3-(2-methylbutoxy)phenyl]pyrazin-2-yl] ester Formula: C32H40N2O6 MolecularWeight: 548.6698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC(=O)OC1=CC=C(C=C1)C(=O)OC2=NC=CN=C2C3=CC(=CC=C3)OCC(C)CC

Isomeric SMILES

CCCCCCCCCOC(=O)OC1=CC=C(C=C1)C(=O)OC2=NC=CN=C2C3=CC(=CC=C3)OCC(C)CC

InChI

InChI=1S/C32H40N2O6/c1-4-6-7-8-9-10-11-21-37-32(36)39-27-17-15-25(16-18-27)31(35)40-30-29(33-19-20-34-30)26-13-12-14-28(22-26)38-23-24(3)5-2/h12-20,22,24H,4-11,21,23H2,1-3H3