decyl 2-(3-oxidanylidene-1-pyridin-3-ylcarbonyl-piperazin-2-yl)ethanoate

Systemtic Name: decyl 2-(3-oxidanylidene-1-pyridin-3-ylcarbonyl-piperazin-2-yl)ethanoate Openeye Name: decyl 2-[3-oxo-1-(pyridine-3-carbonyl)piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[oxo(3-pyridinyl)methyl]-2-piperazinyl]acetic acid decyl ester IUPAC Name: decyl 2-[3-oxo-1-(pyridine-3-carbonyl)piperazin-2-yl]acetate Traditional Name: 2-(3-keto-1-nicotinoyl-piperazin-2-yl)acetic acid decyl ester Formula: C22H33N3O4 MolecularWeight: 403.51512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CN=CC=C2

Isomeric SMILES

CCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CN=CC=C2

InChI

InChI=1S/C22H33N3O4/c1-2-3-4-5-6-7-8-9-15-29-20(26)16-19-21(27)24-13-14-25(19)22(28)18-11-10-12-23-17-18/h10-12,17,19H,2-9,13-16H2,1H3,(H,24,27)