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2-(16-methylheptadecanoylamino)oxysulfonylbutanedioic acid

2-(16-methylheptadecanoylamino)oxysulfonylbutanedioic acid

Systemtic Name:2-(16-methylheptadecanoylamino)oxysulfonylbutanedioic acid
Openeye Name:2-(16-methylheptadecanoylamino)oxysulfonylbutanedioic acid
CAS Name:2-[(16-methyl-1-oxoheptadecyl)amino]oxysulfonylbutanedioic acid
IUPAC Name:2-(16-methylheptadecanoylamino)oxysulfonylbutanedioic acid
Traditional Name:2-(16-methylheptadecanoylamino)oxysulfonylsuccinic acid
Formula: C22H41NO8S
MolecularWeight: 479.62784
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCCC(=O)NOS(=O)(=O)C(CC(=O)O)C(=O)O


Isomeric SMILES

CC(C)CCCCCCCCCCCCCCC(=O)NOS(=O)(=O)C(CC(=O)O)C(=O)O


InChI

InChI=1S/C22H41NO8S/c1-18(2)15-13-11-9-7-5-3-4-6-8-10-12-14-16-20(24)23-31-32(29,30)19(22(27)28)17-21(25)26/h18-19H,3-17H2,1-2H3,(H,23,24)(H,25,26)(H,27,28)


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