2-[[(6-propylquinazolin-4-yl)amino]methylidene]propanedioic acid

Systemtic Name: 2-[[(6-propylquinazolin-4-yl)amino]methylidene]propanedioic acid Openeye Name: 2-[[(6-propylquinazolin-4-yl)amino]methylene]propanedioic acid CAS Name: 2-[[(6-propyl-4-quinazolinyl)amino]methylidene]propanedioic acid IUPAC Name: 2-[[(6-propylquinazolin-4-yl)amino]methylidene]propanedioic acid Traditional Name: 2-[[(6-propylquinazolin-4-yl)amino]methylene]malonic acid Formula: C15H15N3O4 MolecularWeight: 301.2973

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(C=C1)N=CN=C2NC=C(C(=O)O)C(=O)O

Isomeric SMILES

CCCC1=CC2=C(C=C1)N=CN=C2NC=C(C(=O)O)C(=O)O

InChI

InChI=1S/C15H15N3O4/c1-2-3-9-4-5-12-10(6-9)13(18-8-17-12)16-7-11(14(19)20)15(21)22/h4-8H,2-3H2,1H3,(H,19,20)(H,21,22)(H,16,17,18)