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

Systemtic Name: 4-(6-hexyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid Openeye Name: 4-(6-hexyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid CAS Name: 4-(6-hexyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid IUPAC Name: 4-(6-hexyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid Traditional Name: 4-(6-hexyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid Formula: C21H26N2O2 MolecularWeight: 338.44334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O2/c1-2-3-4-5-6-15-7-12-19-18(13-15)14-22-20(23-19)16-8-10-17(11-9-16)21(24)25/h8-11,14-15H,2-7,12-13H2,1H3,(H,24,25)