ethyl 6-chloranyl-2-(2-ethoxy-2-oxidanylidene-ethyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-1H-quinazoline-2-carboxylate

Systemtic Name: ethyl 6-chloranyl-2-(2-ethoxy-2-oxidanylidene-ethyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-1H-quinazoline-2-carboxylate Openeye Name: ethyl 3-(tert-butoxycarbonylamino)-6-chloro-2-(2-ethoxy-2-oxo-ethyl)-4-oxo-1H-quinazoline-2-carboxylate CAS Name: 6-chloro-2-(2-ethoxy-2-oxoethyl)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-oxo-1H-quinazoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-2-(2-ethoxy-2-oxoethyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxo-1H-quinazoline-2-carboxylate Traditional Name: 3-(tert-butoxycarbonylamino)-6-chloro-2-(2-ethoxy-2-keto-ethyl)-4-keto-1H-quinazoline-2-carboxylic acid ethyl ester Formula: C20H26ClN3O7 MolecularWeight: 455.88934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1(NC2=C(C=C(C=C2)Cl)C(=O)N1NC(=O)OC(C)(C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)CC1(NC2=C(C=C(C=C2)Cl)C(=O)N1NC(=O)OC(C)(C)C)C(=O)OCC

InChI

InChI=1S/C20H26ClN3O7/c1-6-29-15(25)11-20(17(27)30-7-2)22-14-9-8-12(21)10-13(14)16(26)24(20)23-18(28)31-19(3,4)5/h8-10,22H,6-7,11H2,1-5H3,(H,23,28)