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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)O)OCC4=CC=CC=C4

InChI

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