2-[(E)-octadec-9-enoyl]naphthalene-1-sulfonic acid

Systemtic Name: 2-[(E)-octadec-9-enoyl]naphthalene-1-sulfonic acid Openeye Name: 2-[(E)-octadec-9-enoyl]naphthalene-1-sulfonic acid CAS Name: 2-[(E)-1-oxooctadec-9-enyl]-1-naphthalenesulfonic acid IUPAC Name: 2-[(E)-octadec-9-enoyl]naphthalene-1-sulfonic acid Traditional Name: 2-[(E)-octadec-9-enoyl]naphthalene-1-sulfonic acid Formula: C28H40O4S MolecularWeight: 472.6798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)C1=C(C2=CC=CC=C2C=C1)S(=O)(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)C1=C(C2=CC=CC=C2C=C1)S(=O)(=O)O

InChI

InChI=1S/C28H40O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-27(29)26-23-22-24-19-17-18-20-25(24)28(26)33(30,31)32/h9-10,17-20,22-23H,2-8,11-16,21H2,1H3,(H,30,31,32)/b10-9+