methyl (2R)-2-(2-chlorophenyl)-2-(4-quinazolin-4-ylpiperazin-1-yl)ethanoate

Systemtic Name: methyl (2R)-2-(2-chlorophenyl)-2-(4-quinazolin-4-ylpiperazin-1-yl)ethanoate Openeye Name: methyl (2R)-2-(2-chlorophenyl)-2-(4-quinazolin-4-ylpiperazin-1-yl)acetate CAS Name: (2R)-2-(2-chlorophenyl)-2-[4-(4-quinazolinyl)-1-piperazinyl]acetic acid methyl ester IUPAC Name: methyl (2R)-2-(2-chlorophenyl)-2-(4-quinazolin-4-ylpiperazin-1-yl)acetate Traditional Name: (2R)-2-(2-chlorophenyl)-2-(4-quinazolin-4-ylpiperazino)acetic acid methyl ester Formula: C21H21ClN4O2 MolecularWeight: 396.87004

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1Cl)N2CCN(CC2)C3=NC=NC4=CC=CC=C43

Isomeric SMILES

COC(=O)[C@@H](C1=CC=CC=C1Cl)N2CCN(CC2)C3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C21H21ClN4O2/c1-28-21(27)19(15-6-2-4-8-17(15)22)25-10-12-26(13-11-25)20-16-7-3-5-9-18(16)23-14-24-20/h2-9,14,19H,10-13H2,1H3/t19-/m1/s1