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(4-methoxyphenyl)-[(E)-octadec-9-enyl]sulfamic acid

(4-methoxyphenyl)-[(E)-octadec-9-enyl]sulfamic acid

Systemtic Name:(4-methoxyphenyl)-[(E)-octadec-9-enyl]sulfamic acid
Openeye Name:(4-methoxyphenyl)-[(E)-octadec-9-enyl]sulfamic acid
CAS Name:(4-methoxyphenyl)-[(E)-octadec-9-enyl]sulfamic acid
IUPAC Name:(4-methoxyphenyl)-[(E)-octadec-9-enyl]sulfamic acid
Traditional Name:(4-methoxyphenyl)-[(E)-octadec-9-enyl]sulfamic acid
Formula: C25H43NO4S
MolecularWeight: 453.67822
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCN(C1=CC=C(C=C1)OC)S(=O)(=O)O


Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCN(C1=CC=C(C=C1)OC)S(=O)(=O)O


InChI

InChI=1S/C25H43NO4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-26(31(27,28)29)24-19-21-25(30-2)22-20-24/h10-11,19-22H,3-9,12-18,23H2,1-2H3,(H,27,28,29)/b11-10+


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