prop-2-enyl 2-[3-(7-bromanyl-6-chloranyl-4-oxidanylidene-quinazolin-3-yl)-2-oxidanylidene-propyl]-3-methoxy-piperidine-1-carboxylate

Systemtic Name: prop-2-enyl 2-[3-(7-bromanyl-6-chloranyl-4-oxidanylidene-quinazolin-3-yl)-2-oxidanylidene-propyl]-3-methoxy-piperidine-1-carboxylate Openeye Name: allyl 2-[3-(7-bromo-6-chloro-4-oxo-quinazolin-3-yl)-2-oxo-propyl]-3-methoxy-piperidine-1-carboxylate CAS Name: 2-[3-(7-bromo-6-chloro-4-oxo-3-quinazolinyl)-2-oxopropyl]-3-methoxy-1-piperidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-[3-(7-bromo-6-chloro-4-oxoquinazolin-3-yl)-2-oxopropyl]-3-methoxypiperidine-1-carboxylate Traditional Name: 2-[3-(7-bromo-6-chloro-4-keto-quinazolin-3-yl)-2-keto-propyl]-3-methoxy-piperidine-1-carboxylic acid allyl ester Formula: C21H23BrClN3O5 MolecularWeight: 512.78142

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCCN(C1CC(=O)CN2C=NC3=CC(=C(C=C3C2=O)Cl)Br)C(=O)OCC=C

Isomeric SMILES

COC1CCCN(C1CC(=O)CN2C=NC3=CC(=C(C=C3C2=O)Cl)Br)C(=O)OCC=C

InChI

InChI=1S/C21H23BrClN3O5/c1-3-7-31-21(29)26-6-4-5-19(30-2)18(26)8-13(27)11-25-12-24-17-10-15(22)16(23)9-14(17)20(25)28/h3,9-10,12,18-19H,1,4-8,11H2,2H3