(7-methoxynaphthalen-2-yl) 2-(4-nitrophenyl)sulfanylpropanoate

Systemtic Name: (7-methoxynaphthalen-2-yl) 2-(4-nitrophenyl)sulfanylpropanoate Openeye Name: (7-methoxy-2-naphthyl) 2-(4-nitrophenyl)sulfanylpropanoate CAS Name: 2-[(4-nitrophenyl)thio]propanoic acid (7-methoxy-2-naphthalenyl) ester IUPAC Name: (7-methoxynaphthalen-2-yl) 2-(4-nitrophenyl)sulfanylpropanoate Traditional Name: 2-[(4-nitrophenyl)thio]propionic acid (7-methoxy-2-naphthyl) ester Formula: C20H17NO5S MolecularWeight: 383.41768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1=CC2=C(C=CC(=C2)OC)C=C1)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)OC1=CC2=C(C=CC(=C2)OC)C=C1)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H17NO5S/c1-13(27-19-9-5-16(6-10-19)21(23)24)20(22)26-18-8-4-14-3-7-17(25-2)11-15(14)12-18/h3-13H,1-2H3