(6,7-dimethoxynaphthalen-2-yl)sulfonyl 2-(3-methylsulfanylpropylamino)ethanoate

Systemtic Name: (6,7-dimethoxynaphthalen-2-yl)sulfonyl 2-(3-methylsulfanylpropylamino)ethanoate Openeye Name: (6,7-dimethoxy-2-naphthyl)sulfonyl 2-(3-methylsulfanylpropylamino)acetate CAS Name: 2-[3-(methylthio)propylamino]acetic acid (6,7-dimethoxy-2-naphthalenyl)sulfonyl ester IUPAC Name: (6,7-dimethoxynaphthalen-2-yl)sulfonyl 2-(3-methylsulfanylpropylamino)acetate Traditional Name: 2-[3-(methylthio)propylamino]acetic acid (6,7-dimethoxy-2-naphthyl)sulfonyl ester Formula: C18H23NO6S2 MolecularWeight: 413.50832

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C=C(C=CC2=C1)S(=O)(=O)OC(=O)CNCCCSC)OC

Isomeric SMILES

COC1=C(C=C2C=C(C=CC2=C1)S(=O)(=O)OC(=O)CNCCCSC)OC

InChI

InChI=1S/C18H23NO6S2/c1-23-16-10-13-5-6-15(9-14(13)11-17(16)24-2)27(21,22)25-18(20)12-19-7-4-8-26-3/h5-6,9-11,19H,4,7-8,12H2,1-3H3