[(2S,3R)-2-[3-(7-bromanyl-6-chloranyl-4-oxidanylidene-quinazolin-3-yl)-2-oxidanylidene-propyl]piperidin-3-yl] 2-oxidanylpropanoate

Systemtic Name: [(2S,3R)-2-[3-(7-bromanyl-6-chloranyl-4-oxidanylidene-quinazolin-3-yl)-2-oxidanylidene-propyl]piperidin-3-yl] 2-oxidanylpropanoate Openeye Name: [(2S,3R)-2-[3-(7-bromo-6-chloro-4-oxo-quinazolin-3-yl)-2-oxo-propyl]-3-piperidyl] 2-hydroxypropanoate CAS Name: 2-hydroxypropanoic acid [(2S,3R)-2-[3-(7-bromo-6-chloro-4-oxo-3-quinazolinyl)-2-oxopropyl]-3-piperidinyl] ester IUPAC Name: [(2S,3R)-2-[3-(7-bromo-6-chloro-4-oxoquinazolin-3-yl)-2-oxopropyl]piperidin-3-yl] 2-hydroxypropanoate Traditional Name: 2-hydroxypropionic acid [(2S,3R)-2-[3-(7-bromo-6-chloro-4-keto-quinazolin-3-yl)-2-keto-propyl]-3-piperidyl] ester Formula: C19H21BrClN3O5 MolecularWeight: 486.74414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1CCCNC1CC(=O)CN2C=NC3=CC(=C(C=C3C2=O)Cl)Br)O

Isomeric SMILES

CC(C(=O)O[C@@H]1CCCN[C@H]1CC(=O)CN2C=NC3=CC(=C(C=C3C2=O)Cl)Br)O

InChI

InChI=1S/C19H21BrClN3O5/c1-10(25)19(28)29-17-3-2-4-22-16(17)5-11(26)8-24-9-23-15-7-13(20)14(21)6-12(15)18(24)27/h6-7,9-10,16-17,22,25H,2-5,8H2,1H3/t10?,16-,17+/m0/s1