methyl 5-[4-(4-methoxy-4-oxidanylidene-butyl)naphthalen-1-yl]pentanoate

Systemtic Name: methyl 5-[4-(4-methoxy-4-oxidanylidene-butyl)naphthalen-1-yl]pentanoate Openeye Name: methyl 5-[4-(4-methoxy-4-oxo-butyl)-1-naphthyl]pentanoate CAS Name: 5-[4-(4-methoxy-4-oxobutyl)-1-naphthalenyl]pentanoic acid methyl ester IUPAC Name: methyl 5-[4-(4-methoxy-4-oxobutyl)naphthalen-1-yl]pentanoate Traditional Name: 5-[4-(4-keto-4-methoxy-butyl)-1-naphthyl]valeric acid methyl ester Formula: C21H26O4 MolecularWeight: 342.42874

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCC1=CC=C(C2=CC=CC=C12)CCCC(=O)OC

Isomeric SMILES

COC(=O)CCCCC1=CC=C(C2=CC=CC=C12)CCCC(=O)OC

InChI

InChI=1S/C21H26O4/c1-24-20(22)12-6-3-8-16-14-15-17(9-7-13-21(23)25-2)19-11-5-4-10-18(16)19/h4-5,10-11,14-15H,3,6-9,12-13H2,1-2H3