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

Systemtic Name: 4-(6-heptyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid Openeye Name: 4-(6-heptyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid CAS Name: 4-(6-heptyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid IUPAC Name: 4-(6-heptyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid Traditional Name: 4-(6-heptyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid Formula: C22H28N2O2 MolecularWeight: 352.46992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC2=NC(=NC=C2C1)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCCCCCCC1CCC2=NC(=NC=C2C1)C3=CC=C(C=C3)C(=O)O

InChI

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