3-[4-(diethylamino)but-2-ynyl]-7-methoxy-quinazolin-4-one; ethanedioic acid

Systemtic Name: 3-[4-(diethylamino)but-2-ynyl]-7-methoxy-quinazolin-4-one; ethanedioic acid Openeye Name: 3-[4-(diethylamino)but-2-ynyl]-7-methoxy-quinazolin-4-one; oxalic acid CAS Name: 3-[4-(diethylamino)but-2-ynyl]-7-methoxy-4-quinazolinone; oxalic acid IUPAC Name: 3-[4-(diethylamino)but-2-ynyl]-7-methoxyquinazolin-4-one; oxalic acid Traditional Name: 3-[4-(diethylamino)but-2-ynyl]-7-methoxy-quinazolin-4-one; oxalic acid Formula: C19H23N3O6 MolecularWeight: 389.40242

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC#CCN1C=NC2=C(C1=O)C=CC(=C2)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CCN(CC)CC#CCN1C=NC2=C(C1=O)C=CC(=C2)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H21N3O2.C2H2O4/c1-4-19(5-2)10-6-7-11-20-13-18-16-12-14(22-3)8-9-15(16)17(20)21;3-1(4)2(5)6/h8-9,12-13H,4-5,10-11H2,1-3H3;(H,3,4)(H,5,6)