(6-chloranyl-4-morpholin-4-yl-quinazolin-2-yl)methyl-(furan-2-ylmethyl)-prop-2-ynyl-azanium

Systemtic Name: (6-chloranyl-4-morpholin-4-yl-quinazolin-2-yl)methyl-(furan-2-ylmethyl)-prop-2-ynyl-azanium Openeye Name: (6-chloro-4-morpholino-quinazolin-2-yl)methyl-(2-furylmethyl)-prop-2-ynyl-ammonium CAS Name: [6-chloro-4-(4-morpholinyl)-2-quinazolinyl]methyl-(2-furanylmethyl)-prop-2-ynylammonium IUPAC Name: (6-chloro-4-morpholin-4-ylquinazolin-2-yl)methyl-(furan-2-ylmethyl)-prop-2-ynylazanium Traditional Name: (6-chloro-4-morpholino-quinazolin-2-yl)methyl-(2-furfuryl)-propargyl-ammonium Formula: C21H22ClN4O2+ MolecularWeight: 397.87798

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Descriptors Computed from Structure

Canonical SMILES:

C#CC[NH+](CC1=CC=CO1)CC2=NC3=C(C=C(C=C3)Cl)C(=N2)N4CCOCC4

Isomeric SMILES

C#CC[NH+](CC1=CC=CO1)CC2=NC3=C(C=C(C=C3)Cl)C(=N2)N4CCOCC4

InChI

InChI=1S/C21H21ClN4O2/c1-2-7-25(14-17-4-3-10-28-17)15-20-23-19-6-5-16(22)13-18(19)21(24-20)26-8-11-27-12-9-26/h1,3-6,10,13H,7-9,11-12,14-15H2/p+1