(4-isothiocyanatophenyl) 2-(6-methoxynaphthalen-2-yl)propanoate

Systemtic Name: (4-isothiocyanatophenyl) 2-(6-methoxynaphthalen-2-yl)propanoate Openeye Name: (4-isothiocyanatophenyl) 2-(6-methoxy-2-naphthyl)propanoate CAS Name: 2-(6-methoxy-2-naphthalenyl)propanoic acid (4-isothiocyanatophenyl) ester IUPAC Name: (4-isothiocyanatophenyl) 2-(6-methoxynaphthalen-2-yl)propanoate Traditional Name: 2-(6-methoxy-2-naphthyl)propionic acid (4-isothiocyanatophenyl) ester Formula: C21H17NO3S MolecularWeight: 363.42958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)OC3=CC=C(C=C3)N=C=S

Isomeric SMILES

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)OC3=CC=C(C=C3)N=C=S

InChI

InChI=1S/C21H17NO3S/c1-14(21(23)25-19-9-6-18(7-10-19)22-13-26)15-3-4-17-12-20(24-2)8-5-16(17)11-15/h3-12,14H,1-2H3