1-azanyl-3-octadecylsulfanyl-naphthalen-2-ol

Systemtic Name: 1-azanyl-3-octadecylsulfanyl-naphthalen-2-ol Openeye Name: 1-amino-3-octadecylsulfanyl-naphthalen-2-ol CAS Name: 1-amino-3-(octadecylthio)-2-naphthalenol IUPAC Name: 1-amino-3-octadecylsulfanylnaphthalen-2-ol Traditional Name: 1-amino-3-(stearylthio)-2-naphthol Formula: C28H45NOS MolecularWeight: 443.728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSC1=CC2=CC=CC=C2C(=C1O)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCSC1=CC2=CC=CC=C2C(=C1O)N

InChI

InChI=1S/C28H45NOS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-31-26-23-24-20-17-18-21-25(24)27(29)28(26)30/h17-18,20-21,23,30H,2-16,19,22,29H2,1H3