hexyl [4-(6-pentyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] carbonate

Systemtic Name: hexyl [4-(6-pentyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] carbonate Openeye Name: hexyl [4-(6-pentyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] carbonate CAS Name: carbonic acid hexyl [4-(6-pentyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] ester IUPAC Name: hexyl [4-(6-pentyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] carbonate Traditional Name: carbonic acid [4-(6-amyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] hexyl ester Formula: C26H36N2O3 MolecularWeight: 424.57564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)OC1=CC=C(C=C1)C2=NC=C3CC(CCC3=N2)CCCCC

Isomeric SMILES

CCCCCCOC(=O)OC1=CC=C(C=C1)C2=NC=C3CC(CCC3=N2)CCCCC

InChI

InChI=1S/C26H36N2O3/c1-3-5-7-9-17-30-26(29)31-23-14-12-21(13-15-23)25-27-19-22-18-20(10-8-6-4-2)11-16-24(22)28-25/h12-15,19-20H,3-11,16-18H2,1-2H3