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

Systemtic Name: [3-[3-(2-methylbutoxy)phenyl]pyrazin-2-yl] 4-pentoxycarbonyloxybenzoate Openeye Name: [3-[3-(2-methylbutoxy)phenyl]pyrazin-2-yl] 4-pentoxycarbonyloxybenzoate CAS Name: 4-[oxo(pentoxy)methoxy]benzoic acid [3-[3-(2-methylbutoxy)phenyl]-2-pyrazinyl] ester IUPAC Name: [3-[3-(2-methylbutoxy)phenyl]pyrazin-2-yl] 4-pentoxycarbonyloxybenzoate Traditional Name: 4-amoxycarbonyloxybenzoic acid [3-[3-(2-methylbutoxy)phenyl]pyrazin-2-yl] ester Formula: C28H32N2O6 MolecularWeight: 492.56348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H32N2O6/c1-4-6-7-17-33-28(32)35-23-13-11-21(12-14-23)27(31)36-26-25(29-15-16-30-26)22-9-8-10-24(18-22)34-19-20(3)5-2/h8-16,18,20H,4-7,17,19H2,1-3H3