ethyl 4-[(3-propoxycarbonylphenyl)amino]quinazoline-2-carboxylate

Systemtic Name: ethyl 4-[(3-propoxycarbonylphenyl)amino]quinazoline-2-carboxylate Openeye Name: ethyl 4-(3-propoxycarbonylanilino)quinazoline-2-carboxylate CAS Name: 4-[3-[oxo(propoxy)methyl]anilino]-2-quinazolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-propoxycarbonylanilino)quinazoline-2-carboxylate Traditional Name: 4-(3-propoxycarbonylanilino)quinazoline-2-carboxylic acid ethyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC(=CC=C1)NC2=NC(=NC3=CC=CC=C32)C(=O)OCC

Isomeric SMILES

CCCOC(=O)C1=CC(=CC=C1)NC2=NC(=NC3=CC=CC=C32)C(=O)OCC

InChI

InChI=1S/C21H21N3O4/c1-3-12-28-20(25)14-8-7-9-15(13-14)22-18-16-10-5-6-11-17(16)23-19(24-18)21(26)27-4-2/h5-11,13H,3-4,12H2,1-2H3,(H,22,23,24)