4-[5-(2-azanyl-6-chloranyl-quinazolin-4-yl)-2-methoxy-phenoxy]butanoic acid

Systemtic Name: 4-[5-(2-azanyl-6-chloranyl-quinazolin-4-yl)-2-methoxy-phenoxy]butanoic acid Openeye Name: 4-[5-(2-amino-6-chloro-quinazolin-4-yl)-2-methoxy-phenoxy]butanoic acid CAS Name: 4-[5-(2-amino-6-chloro-4-quinazolinyl)-2-methoxyphenoxy]butanoic acid IUPAC Name: 4-[5-(2-amino-6-chloroquinazolin-4-yl)-2-methoxyphenoxy]butanoic acid Traditional Name: 4-[5-(2-amino-6-chloro-quinazolin-4-yl)-2-methoxy-phenoxy]butyric acid Formula: C19H18ClN3O4 MolecularWeight: 387.81692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Cl)N)OCCCC(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Cl)N)OCCCC(=O)O

InChI

InChI=1S/C19H18ClN3O4/c1-26-15-7-4-11(9-16(15)27-8-2-3-17(24)25)18-13-10-12(20)5-6-14(13)22-19(21)23-18/h4-7,9-10H,2-3,8H2,1H3,(H,24,25)(H2,21,22,23)