methyl 4-[6-acetyloxy-8-[2-(cyclopropylcarbonylamino)ethyl]naphthalen-2-yl]sulfanylbutanoate

Systemtic Name: methyl 4-[6-acetyloxy-8-[2-(cyclopropylcarbonylamino)ethyl]naphthalen-2-yl]sulfanylbutanoate Openeye Name: methyl 4-[[6-acetoxy-8-[2-(cyclopropanecarbonylamino)ethyl]-2-naphthyl]sulfanyl]butanoate CAS Name: 4-[[6-acetyloxy-8-[2-[[cyclopropyl(oxo)methyl]amino]ethyl]-2-naphthalenyl]thio]butanoic acid methyl ester IUPAC Name: methyl 4-[6-acetyloxy-8-[2-(cyclopropanecarbonylamino)ethyl]naphthalen-2-yl]sulfanylbutanoate Traditional Name: 4-[[6-acetoxy-8-[2-(cyclopropanecarbonylamino)ethyl]-2-naphthyl]thio]butyric acid methyl ester Formula: C23H27NO5S MolecularWeight: 429.52918

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC(=C2C=C(C=CC2=C1)SCCCC(=O)OC)CCNC(=O)C3CC3

Isomeric SMILES

CC(=O)OC1=CC(=C2C=C(C=CC2=C1)SCCCC(=O)OC)CCNC(=O)C3CC3

InChI

InChI=1S/C23H27NO5S/c1-15(25)29-19-12-17-7-8-20(30-11-3-4-22(26)28-2)14-21(17)18(13-19)9-10-24-23(27)16-5-6-16/h7-8,12-14,16H,3-6,9-11H2,1-2H3,(H,24,27)