prop-2-enyl (2S)-3-methoxy-2-[2-oxidanylidene-3-(4-oxidanylidenequinazolin-3-yl)propyl]piperidine-1-carboxylate

Systemtic Name: prop-2-enyl (2S)-3-methoxy-2-[2-oxidanylidene-3-(4-oxidanylidenequinazolin-3-yl)propyl]piperidine-1-carboxylate Openeye Name: allyl (2S)-3-methoxy-2-[2-oxo-3-(4-oxoquinazolin-3-yl)propyl]piperidine-1-carboxylate CAS Name: (2S)-3-methoxy-2-[2-oxo-3-(4-oxo-3-quinazolinyl)propyl]-1-piperidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2S)-3-methoxy-2-[2-oxo-3-(4-oxoquinazolin-3-yl)propyl]piperidine-1-carboxylate Traditional Name: (2S)-2-[2-keto-3-(4-ketoquinazolin-3-yl)propyl]-3-methoxy-piperidine-1-carboxylic acid allyl ester Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1CCCN([C@H]1CC(=O)CN2C=NC3=CC=CC=C3C2=O)C(=O)OCC=C

InChI

InChI=1S/C21H25N3O5/c1-3-11-29-21(27)24-10-6-9-19(28-2)18(24)12-15(25)13-23-14-22-17-8-5-4-7-16(17)20(23)26/h3-5,7-8,14,18-19H,1,6,9-13H2,2H3/t18-,19?/m0/s1