2-[[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)amino]methyl]-6-phenyl-benzoic acid

Systemtic Name: 2-[[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)amino]methyl]-6-phenyl-benzoic acid Openeye Name: 2-[[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)amino]methyl]-6-phenyl-benzoic acid CAS Name: 2-[[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)amino]methyl]-6-phenylbenzoic acid IUPAC Name: 2-[[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)amino]methyl]-6-phenylbenzoic acid Traditional Name: 2-[[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)amino]methyl]-6-phenyl-benzoic acid Formula: C23H23N3O2 MolecularWeight: 373.44762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(CCCC2)C(=N1)NCC3=CC=CC(=C3C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C(CCCC2)C(=N1)NCC3=CC=CC(=C3C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C23H23N3O2/c1-15-25-20-13-6-5-11-19(20)22(26-15)24-14-17-10-7-12-18(21(17)23(27)28)16-8-3-2-4-9-16/h2-4,7-10,12H,5-6,11,13-14H2,1H3,(H,27,28)(H,24,25,26)