2-(6-methoxy-7-phenylmethoxy-quinazolin-4-yl)piperazine-1-carboxylic acid

Systemtic Name: 2-(6-methoxy-7-phenylmethoxy-quinazolin-4-yl)piperazine-1-carboxylic acid Openeye Name: 2-(7-benzyloxy-6-methoxy-quinazolin-4-yl)piperazine-1-carboxylic acid CAS Name: 2-(6-methoxy-7-phenylmethoxy-4-quinazolinyl)-1-piperazinecarboxylic acid IUPAC Name: 2-(6-methoxy-7-phenylmethoxyquinazolin-4-yl)piperazine-1-carboxylic acid Traditional Name: 2-(7-benzoxy-6-methoxy-quinazolin-4-yl)piperazine-1-carboxylic acid Formula: C21H22N4O4 MolecularWeight: 394.42378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)C3CNCCN3C(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)C3CNCCN3C(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C21H22N4O4/c1-28-18-9-15-16(10-19(18)29-12-14-5-3-2-4-6-14)23-13-24-20(15)17-11-22-7-8-25(17)21(26)27/h2-6,9-10,13,17,22H,7-8,11-12H2,1H3,(H,26,27)