11-[(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)amino]undecanoic acid

Systemtic Name: 11-[(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)amino]undecanoic acid Openeye Name: 11-[(2-chloro-6,7-dimethoxy-quinazolin-4-yl)amino]undecanoic acid CAS Name: 11-[(2-chloro-6,7-dimethoxy-4-quinazolinyl)amino]undecanoic acid IUPAC Name: 11-[(2-chloro-6,7-dimethoxyquinazolin-4-yl)amino]undecanoic acid Traditional Name: 11-[(2-chloro-6,7-dimethoxy-quinazolin-4-yl)amino]undecanoic acid Formula: C21H30ClN3O4 MolecularWeight: 423.9336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)NCCCCCCCCCCC(=O)O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)NCCCCCCCCCCC(=O)O)OC

InChI

InChI=1S/C21H30ClN3O4/c1-28-17-13-15-16(14-18(17)29-2)24-21(22)25-20(15)23-12-10-8-6-4-3-5-7-9-11-19(26)27/h13-14H,3-12H2,1-2H3,(H,26,27)(H,23,24,25)