2-[3-[[7-(3-chloranylpropoxy)-6-methoxy-quinazolin-4-yl]amino]-1H-pyrazol-5-yl]ethanoic acid

Systemtic Name: 2-[3-[[7-(3-chloranylpropoxy)-6-methoxy-quinazolin-4-yl]amino]-1H-pyrazol-5-yl]ethanoic acid Openeye Name: 2-[3-[[7-(3-chloropropoxy)-6-methoxy-quinazolin-4-yl]amino]-1H-pyrazol-5-yl]acetic acid CAS Name: 2-[3-[[7-(3-chloropropoxy)-6-methoxy-4-quinazolinyl]amino]-1H-pyrazol-5-yl]acetic acid IUPAC Name: 2-[3-[[7-(3-chloropropoxy)-6-methoxyquinazolin-4-yl]amino]-1H-pyrazol-5-yl]acetic acid Traditional Name: 2-[3-[[7-(3-chloropropoxy)-6-methoxy-quinazolin-4-yl]amino]-1H-pyrazol-5-yl]acetic acid Formula: C17H18ClN5O4 MolecularWeight: 391.80892

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=NNC(=C3)CC(=O)O)OCCCCl

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=NNC(=C3)CC(=O)O)OCCCCl

InChI

InChI=1S/C17H18ClN5O4/c1-26-13-7-11-12(8-14(13)27-4-2-3-18)19-9-20-17(11)21-15-5-10(22-23-15)6-16(24)25/h5,7-9H,2-4,6H2,1H3,(H,24,25)(H2,19,20,21,22,23)