[4-(6-butyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] butanoate

Systemtic Name: [4-(6-butyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] butanoate Openeye Name: [4-(6-butyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] butanoate CAS Name: butanoic acid [4-(6-butyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] ester IUPAC Name: [4-(6-butyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] butanoate Traditional Name: butyric acid [4-(6-butyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] ester Formula: C22H28N2O2 MolecularWeight: 352.46992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC2=NC(=NC=C2C1)C3=CC=C(C=C3)OC(=O)CCC

Isomeric SMILES

CCCCC1CCC2=NC(=NC=C2C1)C3=CC=C(C=C3)OC(=O)CCC

InChI

InChI=1S/C22H28N2O2/c1-3-5-7-16-8-13-20-18(14-16)15-23-22(24-20)17-9-11-19(12-10-17)26-21(25)6-4-2/h9-12,15-16H,3-8,13-14H2,1-2H3