[1-(cyclohexylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 5-oxidanylidene-5-(pyridin-2-ylamino)pentanoate

Systemtic Name: [1-(cyclohexylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 5-oxidanylidene-5-(pyridin-2-ylamino)pentanoate Openeye Name: [1-(cyclohexylcarbamoyl)-2-methyl-propyl] 5-oxo-5-(2-pyridylamino)pentanoate CAS Name: 5-oxo-5-(2-pyridinylamino)pentanoic acid [1-(cyclohexylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(cyclohexylamino)-3-methyl-1-oxobutan-2-yl] 5-oxo-5-(pyridin-2-ylamino)pentanoate Traditional Name: 5-keto-5-(2-pyridylamino)valeric acid [1-(cyclohexylcarbamoyl)-2-methyl-propyl] ester Formula: C21H31N3O4 MolecularWeight: 389.48854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1CCCCC1)OC(=O)CCCC(=O)NC2=CC=CC=N2

Isomeric SMILES

CC(C)C(C(=O)NC1CCCCC1)OC(=O)CCCC(=O)NC2=CC=CC=N2

InChI

InChI=1S/C21H31N3O4/c1-15(2)20(21(27)23-16-9-4-3-5-10-16)28-19(26)13-8-12-18(25)24-17-11-6-7-14-22-17/h6-7,11,14-16,20H,3-5,8-10,12-13H2,1-2H3,(H,23,27)(H,22,24,25)