(phenylmethyl) 4-(8-oxidanylidene-6,7-dihydro-5H-naphthalen-2-yl)butanoate

Systemtic Name: (phenylmethyl) 4-(8-oxidanylidene-6,7-dihydro-5H-naphthalen-2-yl)butanoate Openeye Name: benzyl 4-(4-oxotetralin-6-yl)butanoate CAS Name: 4-(8-oxo-6,7-dihydro-5H-naphthalen-2-yl)butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(8-oxo-6,7-dihydro-5H-naphthalen-2-yl)butanoate Traditional Name: 4-(4-ketotetralin-6-yl)butyric acid benzyl ester Formula: C21H22O3 MolecularWeight: 322.39758

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(C=C2)CCCC(=O)OCC3=CC=CC=C3)C(=O)C1

Isomeric SMILES

C1CC2=C(C=C(C=C2)CCCC(=O)OCC3=CC=CC=C3)C(=O)C1

InChI

InChI=1S/C21H22O3/c22-20-10-5-9-18-13-12-16(14-19(18)20)8-4-11-21(23)24-15-17-6-2-1-3-7-17/h1-3,6-7,12-14H,4-5,8-11,15H2