3-(3-methylbutyl)-4-naphthalen-1-ylsulfonyl-phenol

Systemtic Name: 3-(3-methylbutyl)-4-naphthalen-1-ylsulfonyl-phenol Openeye Name: 3-isopentyl-4-(1-naphthylsulfonyl)phenol CAS Name: 3-(3-methylbutyl)-4-(1-naphthalenylsulfonyl)phenol IUPAC Name: 3-(3-methylbutyl)-4-naphthalen-1-ylsulfonylphenol Traditional Name: 3-isoamyl-4-(1-naphthylsulfonyl)phenol Formula: C21H22O3S MolecularWeight: 354.46258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=C(C=CC(=C1)O)S(=O)(=O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(C)CCC1=C(C=CC(=C1)O)S(=O)(=O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H22O3S/c1-15(2)10-11-17-14-18(22)12-13-20(17)25(23,24)21-9-5-7-16-6-3-4-8-19(16)21/h3-9,12-15,22H,10-11H2,1-2H3