chloranylbenzene; (E)-heptadec-8-enethioic S-acid

Systemtic Name: chloranylbenzene; (E)-heptadec-8-enethioic S-acid Openeye Name: chlorobenzene; (E)-heptadec-8-enethioic S-acid CAS Name: chlorobenzene; (E)-8-heptadecenethioic S-acid IUPAC Name: chlorobenzene; (E)-heptadec-8-enethioic S-acid Traditional Name: chlorobenzene; (E)-heptadec-8-enethioic S-acid Formula: C23H37ClOS MolecularWeight: 397.05728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCC(=O)S.C1=CC=C(C=C1)Cl

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCC(=O)S.C1=CC=C(C=C1)Cl

InChI

InChI=1S/C17H32OS.C6H5Cl/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19;7-6-4-2-1-3-5-6/h9-10H,2-8,11-16H2,1H3,(H,18,19);1-5H/b10-9+;