[1-(4-chloranyl-6-methoxy-quinazolin-7-yl)oxy-3-[4-(cyanomethyl)piperazin-1-yl]propan-2-yl] ethanoate

Systemtic Name: [1-(4-chloranyl-6-methoxy-quinazolin-7-yl)oxy-3-[4-(cyanomethyl)piperazin-1-yl]propan-2-yl] ethanoate Openeye Name: [1-[(4-chloro-6-methoxy-quinazolin-7-yl)oxymethyl]-2-[4-(cyanomethyl)piperazin-1-yl]ethyl] acetate CAS Name: acetic acid [1-[(4-chloro-6-methoxy-7-quinazolinyl)oxy]-3-[4-(cyanomethyl)-1-piperazinyl]propan-2-yl] ester IUPAC Name: [1-(4-chloro-6-methoxyquinazolin-7-yl)oxy-3-[4-(cyanomethyl)piperazin-1-yl]propan-2-yl] acetate Traditional Name: acetic acid [1-[(4-chloro-6-methoxy-quinazolin-7-yl)oxymethyl]-2-[4-(cyanomethyl)piperazino]ethyl] ester Formula: C20H24ClN5O4 MolecularWeight: 433.88866

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CN1CCN(CC1)CC#N)COC2=C(C=C3C(=C2)N=CN=C3Cl)OC

Isomeric SMILES

CC(=O)OC(CN1CCN(CC1)CC#N)COC2=C(C=C3C(=C2)N=CN=C3Cl)OC

InChI

InChI=1S/C20H24ClN5O4/c1-14(27)30-15(11-26-7-5-25(4-3-22)6-8-26)12-29-19-10-17-16(9-18(19)28-2)20(21)24-13-23-17/h9-10,13,15H,4-8,11-12H2,1-2H3