4-[[6,8-bis(chloranyl)quinazolin-4-yl]amino]butanoate

Systemtic Name: 4-[[6,8-bis(chloranyl)quinazolin-4-yl]amino]butanoate Openeye Name: 4-[(6,8-dichloroquinazolin-4-yl)amino]butanoate CAS Name: 4-[(6,8-dichloro-4-quinazolinyl)amino]butanoate IUPAC Name: 4-[(6,8-dichloroquinazolin-4-yl)amino]butanoate Traditional Name: 4-[(6,8-dichloroquinazolin-4-yl)amino]butyrate Formula: C12H10Cl2N3O2- MolecularWeight: 299.1327

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C2C(=C1Cl)N=CN=C2NCCCC(=O)[O-])Cl

Isomeric SMILES

C1=C(C=C2C(=C1Cl)N=CN=C2NCCCC(=O)[O-])Cl

InChI

InChI=1S/C12H11Cl2N3O2/c13-7-4-8-11(9(14)5-7)16-6-17-12(8)15-3-1-2-10(18)19/h4-6H,1-3H2,(H,18,19)(H,15,16,17)/p-1