5-(dipentylamino)-4-[(4-ethanoylphenyl)sulfonylmethyl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-(dipentylamino)-4-[(4-ethanoylphenyl)sulfonylmethyl]-5-oxidanylidene-pentanoic acid Openeye Name: 4-[(4-acetylphenyl)sulfonylmethyl]-5-(dipentylamino)-5-oxo-pentanoic acid CAS Name: 4-[(4-acetylphenyl)sulfonylmethyl]-5-(dipentylamino)-5-oxopentanoic acid IUPAC Name: 4-[(4-acetylphenyl)sulfonylmethyl]-5-(dipentylamino)-5-oxopentanoic acid Traditional Name: 4-[(4-acetylphenyl)sulfonylmethyl]-5-(diamylamino)-5-keto-valeric acid Formula: C24H37NO6S MolecularWeight: 467.61868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)C(=O)C(CCC(=O)O)CS(=O)(=O)C1=CC=C(C=C1)C(=O)C

Isomeric SMILES

CCCCCN(CCCCC)C(=O)C(CCC(=O)O)CS(=O)(=O)C1=CC=C(C=C1)C(=O)C

InChI

InChI=1S/C24H37NO6S/c1-4-6-8-16-25(17-9-7-5-2)24(29)21(12-15-23(27)28)18-32(30,31)22-13-10-20(11-14-22)19(3)26/h10-11,13-14,21H,4-9,12,15-18H2,1-3H3,(H,27,28)