2-[1-(isothiocyanatomethyl)cyclobutyl]naphthalene

Systemtic Name: 2-[1-(isothiocyanatomethyl)cyclobutyl]naphthalene Openeye Name: 2-[1-(isothiocyanatomethyl)cyclobutyl]naphthalene CAS Name: 2-[1-(isothiocyanatomethyl)cyclobutyl]naphthalene IUPAC Name: 2-[1-(isothiocyanatomethyl)cyclobutyl]naphthalene Traditional Name: 2-[1-(isothiocyanatomethyl)cyclobutyl]naphthalene Formula: C16H15NS MolecularWeight: 253.362

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)(CN=C=S)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C1CC(C1)(CN=C=S)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C16H15NS/c18-12-17-11-16(8-3-9-16)15-7-6-13-4-1-2-5-14(13)10-15/h1-2,4-7,10H,3,8-9,11H2