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

Systemtic Name: [4-(6-butyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] heptanoate Openeye Name: [4-(6-butyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] heptanoate CAS Name: heptanoic 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] heptanoate Traditional Name: enanthic acid [4-(6-butyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] ester Formula: C25H34N2O2 MolecularWeight: 394.54966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OC1=CC=C(C=C1)C2=NC=C3CC(CCC3=N2)CCCC

Isomeric SMILES

CCCCCCC(=O)OC1=CC=C(C=C1)C2=NC=C3CC(CCC3=N2)CCCC

InChI

InChI=1S/C25H34N2O2/c1-3-5-7-8-10-24(28)29-22-14-12-20(13-15-22)25-26-18-21-17-19(9-6-4-2)11-16-23(21)27-25/h12-15,18-19H,3-11,16-17H2,1-2H3