[2-[4-(4-hexoxyphenyl)phenyl]pyrimidin-5-yl] 2-pentoxypropanoate

Systemtic Name: [2-[4-(4-hexoxyphenyl)phenyl]pyrimidin-5-yl] 2-pentoxypropanoate Openeye Name: [2-[4-(4-hexoxyphenyl)phenyl]pyrimidin-5-yl] 2-pentoxypropanoate CAS Name: 2-pentoxypropanoic acid [2-[4-(4-hexoxyphenyl)phenyl]-5-pyrimidinyl] ester IUPAC Name: [2-[4-(4-hexoxyphenyl)phenyl]pyrimidin-5-yl] 2-pentoxypropanoate Traditional Name: 2-amoxypropionic acid [2-[4-(4-hexoxyphenyl)phenyl]pyrimidin-5-yl] ester Formula: C30H38N2O4 MolecularWeight: 490.63372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=C(C=N3)OC(=O)C(C)OCCCCC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=C(C=N3)OC(=O)C(C)OCCCCC

InChI

InChI=1S/C30H38N2O4/c1-4-6-8-10-20-35-27-17-15-25(16-18-27)24-11-13-26(14-12-24)29-31-21-28(22-32-29)36-30(33)23(3)34-19-9-7-5-2/h11-18,21-23H,4-10,19-20H2,1-3H3