2-[4-[2-(diethylazaniumyl)ethylamino]quinazolin-2-yl]-6-methoxy-phenolate

Systemtic Name: 2-[4-[2-(diethylazaniumyl)ethylamino]quinazolin-2-yl]-6-methoxy-phenolate Openeye Name: 2-[4-[2-(diethylammonio)ethylamino]quinazolin-2-yl]-6-methoxy-phenolate CAS Name: 2-[4-[2-(diethylammonio)ethylamino]-2-quinazolinyl]-6-methoxyphenolate IUPAC Name: 2-[4-[2-(diethylazaniumyl)ethylamino]quinazolin-2-yl]-6-methoxyphenolate Traditional Name: 2-[4-[2-(diethylammonio)ethylamino]quinazolin-2-yl]-6-methoxy-phenolate Formula: C21H26N4O2 MolecularWeight: 366.45674

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC1=NC(=NC2=CC=CC=C21)C3=C(C(=CC=C3)OC)[O-]

Isomeric SMILES

CC[NH+](CC)CCNC1=NC(=NC2=CC=CC=C21)C3=C(C(=CC=C3)OC)[O-]

InChI

InChI=1S/C21H26N4O2/c1-4-25(5-2)14-13-22-20-15-9-6-7-11-17(15)23-21(24-20)16-10-8-12-18(27-3)19(16)26/h6-12,26H,4-5,13-14H2,1-3H3,(H,22,23,24)