4-(6-butyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid

Systemtic Name: 4-(6-butyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid Openeye Name: 4-(6-butyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid CAS Name: 4-(6-butyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid IUPAC Name: 4-(6-butyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid Traditional Name: 4-(6-butyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid Formula: C19H22N2O2 MolecularWeight: 310.39018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O2/c1-2-3-4-13-5-10-17-16(11-13)12-20-18(21-17)14-6-8-15(9-7-14)19(22)23/h6-9,12-13H,2-5,10-11H2,1H3,(H,22,23)