[1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 3-[2,4-bis(oxidanylidene)quinazolin-1-yl]propanoate

Systemtic Name: [1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 3-[2,4-bis(oxidanylidene)quinazolin-1-yl]propanoate Openeye Name: [2-(cyclohexylmethylamino)-1-methyl-2-oxo-ethyl] 3-(2,4-dioxoquinazolin-1-yl)propanoate CAS Name: 3-(2,4-dioxo-1-quinazolinyl)propanoic acid [1-(cyclohexylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclohexylmethylamino)-1-oxopropan-2-yl] 3-(2,4-dioxoquinazolin-1-yl)propanoate Traditional Name: 3-(2,4-diketoquinazolin-1-yl)propionic acid [2-(cyclohexylmethylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H27N3O5 MolecularWeight: 401.45618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1CCCCC1)OC(=O)CCN2C3=CC=CC=C3C(=O)NC2=O

Isomeric SMILES

CC(C(=O)NCC1CCCCC1)OC(=O)CCN2C3=CC=CC=C3C(=O)NC2=O

InChI

InChI=1S/C21H27N3O5/c1-14(19(26)22-13-15-7-3-2-4-8-15)29-18(25)11-12-24-17-10-6-5-9-16(17)20(27)23-21(24)28/h5-6,9-10,14-15H,2-4,7-8,11-13H2,1H3,(H,22,26)(H,23,27,28)