dodecyl 2-[1-(4-acetamidophenyl)sulfonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: dodecyl 2-[1-(4-acetamidophenyl)sulfonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: dodecyl 2-[1-(4-acetamidophenyl)sulfonyl-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-(4-acetamidophenyl)sulfonyl-3-oxo-2-piperazinyl]acetic acid dodecyl ester IUPAC Name: dodecyl 2-[1-(4-acetamidophenyl)sulfonyl-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(4-acetamidophenyl)sulfonyl-3-keto-piperazin-2-yl]acetic acid lauryl ester Formula: C26H41N3O6S MolecularWeight: 523.68524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C26H41N3O6S/c1-3-4-5-6-7-8-9-10-11-12-19-35-25(31)20-24-26(32)27-17-18-29(24)36(33,34)23-15-13-22(14-16-23)28-21(2)30/h13-16,24H,3-12,17-20H2,1-2H3,(H,27,32)(H,28,30)