ethyl 5-[2-[(2,6-diethylphenyl)carbamoyl]pyrazolidin-1-yl]-5-oxidanylidene-pentanoate

Systemtic Name: ethyl 5-[2-[(2,6-diethylphenyl)carbamoyl]pyrazolidin-1-yl]-5-oxidanylidene-pentanoate Openeye Name: ethyl 5-[2-[(2,6-diethylphenyl)carbamoyl]pyrazolidin-1-yl]-5-oxo-pentanoate CAS Name: 5-[2-[(2,6-diethylanilino)-oxomethyl]-1-pyrazolidinyl]-5-oxopentanoic acid ethyl ester IUPAC Name: ethyl 5-[2-[(2,6-diethylphenyl)carbamoyl]pyrazolidin-1-yl]-5-oxopentanoate Traditional Name: 5-[2-[(2,6-diethylphenyl)carbamoyl]pyrazolidin-1-yl]-5-keto-valeric acid ethyl ester Formula: C21H31N3O4 MolecularWeight: 389.48854

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)N2CCCN2C(=O)CCCC(=O)OCC

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)N2CCCN2C(=O)CCCC(=O)OCC

InChI

InChI=1S/C21H31N3O4/c1-4-16-10-7-11-17(5-2)20(16)22-21(27)24-15-9-14-23(24)18(25)12-8-13-19(26)28-6-3/h7,10-11H,4-6,8-9,12-15H2,1-3H3,(H,22,27)