[4-acetyloxy-3-butoxy-7-(2-ethylphenyl)sulfanyl-naphthalen-1-yl] ethanoate

Systemtic Name: [4-acetyloxy-3-butoxy-7-(2-ethylphenyl)sulfanyl-naphthalen-1-yl] ethanoate Openeye Name: [4-acetoxy-3-butoxy-7-(2-ethylphenyl)sulfanyl-1-naphthyl] acetate CAS Name: acetic acid [4-acetyloxy-3-butoxy-7-[(2-ethylphenyl)thio]-1-naphthalenyl] ester IUPAC Name: [4-acetyloxy-3-butoxy-7-(2-ethylphenyl)sulfanylnaphthalen-1-yl] acetate Traditional Name: acetic acid [4-acetoxy-3-butoxy-7-[(2-ethylphenyl)thio]-1-naphthyl] ester Formula: C26H28O5S MolecularWeight: 452.56252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C2=C(C=C(C=C2)SC3=CC=CC=C3CC)C(=C1)OC(=O)C)OC(=O)C

Isomeric SMILES

CCCCOC1=C(C2=C(C=C(C=C2)SC3=CC=CC=C3CC)C(=C1)OC(=O)C)OC(=O)C

InChI

InChI=1S/C26H28O5S/c1-5-7-14-29-24-16-23(30-17(3)27)22-15-20(12-13-21(22)26(24)31-18(4)28)32-25-11-9-8-10-19(25)6-2/h8-13,15-16H,5-7,14H2,1-4H3