(2S)-1-[[4-[2-(2-methoxyphenyl)ethylamino]quinazolin-2-yl]methyl]pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-1-[[4-[2-(2-methoxyphenyl)ethylamino]quinazolin-2-yl]methyl]pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-1-[[4-[2-(2-methoxyphenyl)ethylamino]quinazolin-2-yl]methyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-1-[[4-[2-(2-methoxyphenyl)ethylamino]-2-quinazolinyl]methyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-1-[[4-[2-(2-methoxyphenyl)ethylamino]quinazolin-2-yl]methyl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-1-[[4-[2-(2-methoxyphenyl)ethylamino]quinazolin-2-yl]methyl]pyrrolidin-1-ium-2-carboxamide Formula: C23H28N5O2+ MolecularWeight: 406.50072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCNC2=NC(=NC3=CC=CC=C32)C[NH+]4CCCC4C(=O)N

Isomeric SMILES

COC1=CC=CC=C1CCNC2=NC(=NC3=CC=CC=C32)C[NH+]4CCC[C@H]4C(=O)N

InChI

InChI=1S/C23H27N5O2/c1-30-20-11-5-2-7-16(20)12-13-25-23-17-8-3-4-9-18(17)26-21(27-23)15-28-14-6-10-19(28)22(24)29/h2-5,7-9,11,19H,6,10,12-15H2,1H3,(H2,24,29)(H,25,26,27)/p+1/t19-/m0/s1