methyl 2-[[2-(4-propoxyphenyl)quinazolin-4-yl]amino]propanoate

Systemtic Name: methyl 2-[[2-(4-propoxyphenyl)quinazolin-4-yl]amino]propanoate Openeye Name: methyl 2-[[2-(4-propoxyphenyl)quinazolin-4-yl]amino]propanoate CAS Name: 2-[[2-(4-propoxyphenyl)-4-quinazolinyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-[[2-(4-propoxyphenyl)quinazolin-4-yl]amino]propanoate Traditional Name: 2-[[2-(4-propoxyphenyl)quinazolin-4-yl]amino]propionic acid methyl ester Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)NC(C)C(=O)OC

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)NC(C)C(=O)OC

InChI

InChI=1S/C21H23N3O3/c1-4-13-27-16-11-9-15(10-12-16)19-23-18-8-6-5-7-17(18)20(24-19)22-14(2)21(25)26-3/h5-12,14H,4,13H2,1-3H3,(H,22,23,24)