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

Systemtic Name: 4-(6-octyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid Openeye Name: 4-(6-octyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid CAS Name: 4-(6-octyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid IUPAC Name: 4-(6-octyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid Traditional Name: 4-(6-octyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzoic acid Formula: C23H30N2O2 MolecularWeight: 366.4965

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC2=NC(=NC=C2C1)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCCCCCCCC1CCC2=NC(=NC=C2C1)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C23H30N2O2/c1-2-3-4-5-6-7-8-17-9-14-21-20(15-17)16-24-22(25-21)18-10-12-19(13-11-18)23(26)27/h10-13,16-17H,2-9,14-15H2,1H3,(H,26,27)