ethyl 4-[[4-(2-methylpropoxycarbonyl)phenyl]amino]quinazoline-2-carboxylate

Systemtic Name: ethyl 4-[[4-(2-methylpropoxycarbonyl)phenyl]amino]quinazoline-2-carboxylate Openeye Name: ethyl 4-(4-isobutoxycarbonylanilino)quinazoline-2-carboxylate CAS Name: 4-[4-[2-methylpropoxy(oxo)methyl]anilino]-2-quinazolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(2-methylpropoxycarbonyl)anilino]quinazoline-2-carboxylate Traditional Name: 4-(4-isobutoxycarbonylanilino)quinazoline-2-carboxylic acid ethyl ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=CC=CC=C2C(=N1)NC3=CC=C(C=C3)C(=O)OCC(C)C

Isomeric SMILES

CCOC(=O)C1=NC2=CC=CC=C2C(=N1)NC3=CC=C(C=C3)C(=O)OCC(C)C

InChI

InChI=1S/C22H23N3O4/c1-4-28-22(27)20-24-18-8-6-5-7-17(18)19(25-20)23-16-11-9-15(10-12-16)21(26)29-13-14(2)3/h5-12,14H,4,13H2,1-3H3,(H,23,24,25)