3-[(7-chloranyl-2-cyclopropyl-quinazolin-4-yl)-(3-morpholin-4-ylpropyl)amino]propanoic acid

Systemtic Name: 3-[(7-chloranyl-2-cyclopropyl-quinazolin-4-yl)-(3-morpholin-4-ylpropyl)amino]propanoic acid Openeye Name: 3-[(7-chloro-2-cyclopropyl-quinazolin-4-yl)-(3-morpholinopropyl)amino]propanoic acid CAS Name: 3-[(7-chloro-2-cyclopropyl-4-quinazolinyl)-[3-(4-morpholinyl)propyl]amino]propanoic acid IUPAC Name: 3-[(7-chloro-2-cyclopropylquinazolin-4-yl)-(3-morpholin-4-ylpropyl)amino]propanoic acid Traditional Name: 3-[(7-chloro-2-cyclopropyl-quinazolin-4-yl)-(3-morpholinopropyl)amino]propionic acid Formula: C21H27ClN4O3 MolecularWeight: 418.91708

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC3=C(C=CC(=C3)Cl)C(=N2)N(CCCN4CCOCC4)CCC(=O)O

Isomeric SMILES

C1CC1C2=NC3=C(C=CC(=C3)Cl)C(=N2)N(CCCN4CCOCC4)CCC(=O)O

InChI

InChI=1S/C21H27ClN4O3/c22-16-4-5-17-18(14-16)23-20(15-2-3-15)24-21(17)26(9-6-19(27)28)8-1-7-25-10-12-29-13-11-25/h4-5,14-15H,1-3,6-13H2,(H,27,28)