[3-[(6-oxidanylnaphthalen-2-yl)methyl]phenyl] butanoate

Systemtic Name: [3-[(6-oxidanylnaphthalen-2-yl)methyl]phenyl] butanoate Openeye Name: [3-[(6-hydroxy-2-naphthyl)methyl]phenyl] butanoate CAS Name: butanoic acid [3-[(6-hydroxy-2-naphthalenyl)methyl]phenyl] ester IUPAC Name: [3-[(6-hydroxynaphthalen-2-yl)methyl]phenyl] butanoate Traditional Name: butyric acid [3-[(6-hydroxy-2-naphthyl)methyl]phenyl] ester Formula: C21H20O3 MolecularWeight: 320.3817

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CC=CC(=C1)CC2=CC3=C(C=C2)C=C(C=C3)O

Isomeric SMILES

CCCC(=O)OC1=CC=CC(=C1)CC2=CC3=C(C=C2)C=C(C=C3)O

InChI

InChI=1S/C21H20O3/c1-2-4-21(23)24-20-6-3-5-15(13-20)11-16-7-8-18-14-19(22)10-9-17(18)12-16/h3,5-10,12-14,22H,2,4,11H2,1H3