(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 1-(furan-2-ylcarbonyl)piperidine-3-carboxylate

Systemtic Name: (8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 1-(furan-2-ylcarbonyl)piperidine-3-carboxylate Openeye Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 1-(furan-2-carbonyl)piperidine-3-carboxylate CAS Name: 1-[2-furanyl(oxo)methyl]-3-piperidinecarboxylic acid (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 1-(furan-2-carbonyl)piperidine-3-carboxylate Traditional Name: 1-(2-furoyl)nipecotic acid (4-keto-8-methyl-1H-quinazolin-2-yl)methyl ester Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=NC2=O)COC(=O)C3CCCN(C3)C(=O)C4=CC=CO4

Isomeric SMILES

CC1=CC=CC2=C1NC(=NC2=O)COC(=O)C3CCCN(C3)C(=O)C4=CC=CO4

InChI

InChI=1S/C21H21N3O5/c1-13-5-2-7-15-18(13)22-17(23-19(15)25)12-29-21(27)14-6-3-9-24(11-14)20(26)16-8-4-10-28-16/h2,4-5,7-8,10,14H,3,6,9,11-12H2,1H3,(H,22,23,25)