(7-methoxynaphthalen-2-yl) 2-(4-aminocarbonyl-2-nitro-phenyl)sulfanylethanoate

Systemtic Name: (7-methoxynaphthalen-2-yl) 2-(4-aminocarbonyl-2-nitro-phenyl)sulfanylethanoate Openeye Name: (7-methoxy-2-naphthyl) 2-(4-carbamoyl-2-nitro-phenyl)sulfanylacetate CAS Name: 2-[(4-carbamoyl-2-nitrophenyl)thio]acetic acid (7-methoxy-2-naphthalenyl) ester IUPAC Name: (7-methoxynaphthalen-2-yl) 2-(4-carbamoyl-2-nitrophenyl)sulfanylacetate Traditional Name: 2-[(4-carbamoyl-2-nitro-phenyl)thio]acetic acid (7-methoxy-2-naphthyl) ester Formula: C20H16N2O6S MolecularWeight: 412.41584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=CC(=C2)OC(=O)CSC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)C=CC(=C2)OC(=O)CSC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C20H16N2O6S/c1-27-15-5-2-12-3-6-16(9-14(12)8-15)28-19(23)11-29-18-7-4-13(20(21)24)10-17(18)22(25)26/h2-10H,11H2,1H3,(H2,21,24)