prop-2-enyl (2R,3S)-2-[3-(6-cyano-4-oxidanylidene-quinazolin-3-yl)-2-oxidanylidene-propyl]-3-oxidanyl-piperidine-1-carboxylate

Systemtic Name: prop-2-enyl (2R,3S)-2-[3-(6-cyano-4-oxidanylidene-quinazolin-3-yl)-2-oxidanylidene-propyl]-3-oxidanyl-piperidine-1-carboxylate Openeye Name: allyl (2R,3S)-2-[3-(6-cyano-4-oxo-quinazolin-3-yl)-2-oxo-propyl]-3-hydroxy-piperidine-1-carboxylate CAS Name: (2R,3S)-2-[3-(6-cyano-4-oxo-3-quinazolinyl)-2-oxopropyl]-3-hydroxy-1-piperidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2R,3S)-2-[3-(6-cyano-4-oxoquinazolin-3-yl)-2-oxopropyl]-3-hydroxypiperidine-1-carboxylate Traditional Name: (2R,3S)-2-[3-(6-cyano-4-keto-quinazolin-3-yl)-2-keto-propyl]-3-hydroxy-piperidine-1-carboxylic acid allyl ester Formula: C21H22N4O5 MolecularWeight: 410.42318

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)N1CCCC(C1CC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)C#N)O

Isomeric SMILES

C=CCOC(=O)N1CCC[C@@H]([C@H]1CC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)C#N)O

InChI

InChI=1S/C21H22N4O5/c1-2-8-30-21(29)25-7-3-4-19(27)18(25)10-15(26)12-24-13-23-17-6-5-14(11-22)9-16(17)20(24)28/h2,5-6,9,13,18-19,27H,1,3-4,7-8,10,12H2/t18-,19+/m1/s1