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

Systemtic Name: hexyl [4-(6-hexyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] carbonate Openeye Name: hexyl [4-(6-hexyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] carbonate CAS Name: carbonic acid hexyl [4-(6-hexyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] ester IUPAC Name: hexyl [4-(6-hexyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] carbonate Traditional Name: carbonic acid hexyl [4-(6-hexyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] ester Formula: C27H38N2O3 MolecularWeight: 438.60222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC2=NC(=NC=C2C1)C3=CC=C(C=C3)OC(=O)OCCCCCC

Isomeric SMILES

CCCCCCC1CCC2=NC(=NC=C2C1)C3=CC=C(C=C3)OC(=O)OCCCCCC

InChI

InChI=1S/C27H38N2O3/c1-3-5-7-9-11-21-12-17-25-23(19-21)20-28-26(29-25)22-13-15-24(16-14-22)32-27(30)31-18-10-8-6-4-2/h13-16,20-21H,3-12,17-19H2,1-2H3