[4-(5-methyl-8-propan-2-yl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] benzoate

Systemtic Name: [4-(5-methyl-8-propan-2-yl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] benzoate Openeye Name: [4-(8-isopropyl-5-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] benzoate CAS Name: benzoic acid [4-(5-methyl-8-propan-2-yl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] ester IUPAC Name: [4-(5-methyl-8-propan-2-yl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] benzoate Traditional Name: benzoic acid [4-(8-isopropyl-5-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] ester Formula: C25H26N2O2 MolecularWeight: 386.48614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C2=NC(=NC=C12)C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4)C(C)C

Isomeric SMILES

CC1CCC(C2=NC(=NC=C12)C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4)C(C)C

InChI

InChI=1S/C25H26N2O2/c1-16(2)21-14-9-17(3)22-15-26-24(27-23(21)22)18-10-12-20(13-11-18)29-25(28)19-7-5-4-6-8-19/h4-8,10-13,15-17,21H,9,14H2,1-3H3