2-[[5-(3-chlorophenyl)-8-methoxy-2-(methylamino)quinazolin-7-yl]methyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[[5-(3-chlorophenyl)-8-methoxy-2-(methylamino)quinazolin-7-yl]methyl-methyl-amino]ethanoic acid Openeye Name: 2-[[5-(3-chlorophenyl)-8-methoxy-2-(methylamino)quinazolin-7-yl]methyl-methyl-amino]acetic acid CAS Name: 2-[[5-(3-chlorophenyl)-8-methoxy-2-(methylamino)-7-quinazolinyl]methyl-methylamino]acetic acid IUPAC Name: 2-[[5-(3-chlorophenyl)-8-methoxy-2-(methylamino)quinazolin-7-yl]methyl-methylamino]acetic acid Traditional Name: 2-[[5-(3-chlorophenyl)-8-methoxy-2-(methylamino)quinazolin-7-yl]methyl-methyl-amino]acetic acid Formula: C20H21ClN4O3 MolecularWeight: 400.85874

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=C2C(=CC(=C(C2=N1)OC)CN(C)CC(=O)O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CNC1=NC=C2C(=CC(=C(C2=N1)OC)CN(C)CC(=O)O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H21ClN4O3/c1-22-20-23-9-16-15(12-5-4-6-14(21)7-12)8-13(10-25(2)11-17(26)27)19(28-3)18(16)24-20/h4-9H,10-11H2,1-3H3,(H,26,27)(H,22,23,24)