sodium 3-[3-butyl-2,4-bis(oxidanylidene)quinazolin-1-yl]propanoate

Systemtic Name: sodium 3-[3-butyl-2,4-bis(oxidanylidene)quinazolin-1-yl]propanoate Openeye Name: sodium 3-(3-butyl-2,4-dioxo-quinazolin-1-yl)propanoate CAS Name: sodium 3-(3-butyl-2,4-dioxo-1-quinazolinyl)propanoate IUPAC Name: sodium 3-(3-butyl-2,4-dioxoquinazolin-1-yl)propanoate Traditional Name: sodium 3-(3-butyl-2,4-diketo-quinazolin-1-yl)propionate Formula: C15H17N2NaO4 MolecularWeight: 312.29625

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N(C1=O)CCC(=O)[O-].[Na+]

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N(C1=O)CCC(=O)[O-].[Na+]

InChI

InChI=1S/C15H18N2O4.Na/c1-2-3-9-17-14(20)11-6-4-5-7-12(11)16(15(17)21)10-8-13(18)19;/h4-7H,2-3,8-10H2,1H3,(H,18,19);/q;+1/p-1