prop-2-enyl 4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazine-1-carboxylate

Systemtic Name: prop-2-enyl 4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazine-1-carboxylate Openeye Name: allyl 4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazine-1-carboxylate CAS Name: 4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazine-1-carboxylate Traditional Name: 4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazine-1-carboxylic acid allyl ester Formula: C18H23N5O4 MolecularWeight: 373.40632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)OCC=C)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)OCC=C)N)OC

InChI

InChI=1S/C18H23N5O4/c1-4-9-27-18(24)23-7-5-22(6-8-23)17-20-13-11-15(26-3)14(25-2)10-12(13)16(19)21-17/h4,10-11H,1,5-9H2,2-3H3,(H2,19,20,21)