1-[2-[(6-methyl-4-phenyl-quinazolin-2-yl)amino]ethanoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-[(6-methyl-4-phenyl-quinazolin-2-yl)amino]ethanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-[(6-methyl-4-phenyl-quinazolin-2-yl)amino]acetyl]piperidine-4-carboxylic acid CAS Name: 1-[2-[(6-methyl-4-phenyl-2-quinazolinyl)amino]-1-oxoethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-[(6-methyl-4-phenylquinazolin-2-yl)amino]acetyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-[(6-methyl-4-phenyl-quinazolin-2-yl)amino]acetyl]isonipecotic acid Formula: C23H24N4O3 MolecularWeight: 404.46166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2C3=CC=CC=C3)NCC(=O)N4CCC(CC4)C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2C3=CC=CC=C3)NCC(=O)N4CCC(CC4)C(=O)O

InChI

InChI=1S/C23H24N4O3/c1-15-7-8-19-18(13-15)21(16-5-3-2-4-6-16)26-23(25-19)24-14-20(28)27-11-9-17(10-12-27)22(29)30/h2-8,13,17H,9-12,14H2,1H3,(H,29,30)(H,24,25,26)