4-methyl-3-[[2-(morpholin-4-ylmethyl)quinazolin-4-yl]amino]benzoic acid

Systemtic Name: 4-methyl-3-[[2-(morpholin-4-ylmethyl)quinazolin-4-yl]amino]benzoic acid Openeye Name: 4-methyl-3-[[2-(morpholinomethyl)quinazolin-4-yl]amino]benzoic acid CAS Name: 4-methyl-3-[[2-(4-morpholinylmethyl)-4-quinazolinyl]amino]benzoic acid IUPAC Name: 4-methyl-3-[[2-(morpholin-4-ylmethyl)quinazolin-4-yl]amino]benzoic acid Traditional Name: 4-methyl-3-[[2-(morpholinomethyl)quinazolin-4-yl]amino]benzoic acid Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC2=NC(=NC3=CC=CC=C32)CN4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC2=NC(=NC3=CC=CC=C32)CN4CCOCC4

InChI

InChI=1S/C21H22N4O3/c1-14-6-7-15(21(26)27)12-18(14)23-20-16-4-2-3-5-17(16)22-19(24-20)13-25-8-10-28-11-9-25/h2-7,12H,8-11,13H2,1H3,(H,26,27)(H,22,23,24)