3-ethylsulfanyl-2-(4-methoxyphenyl)-4-methyl-5-(3-nitrophenyl)phenol

Systemtic Name: 3-ethylsulfanyl-2-(4-methoxyphenyl)-4-methyl-5-(3-nitrophenyl)phenol Openeye Name: 3-ethylsulfanyl-2-(4-methoxyphenyl)-4-methyl-5-(3-nitrophenyl)phenol CAS Name: 3-(ethylthio)-2-(4-methoxyphenyl)-4-methyl-5-(3-nitrophenyl)phenol IUPAC Name: 3-ethylsulfanyl-2-(4-methoxyphenyl)-4-methyl-5-(3-nitrophenyl)phenol Traditional Name: 3-(ethylthio)-2-(4-methoxyphenyl)-4-methyl-5-(3-nitrophenyl)phenol Formula: C22H21NO4S MolecularWeight: 395.47144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C(=CC(=C1C2=CC=C(C=C2)OC)O)C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CCSC1=C(C(=CC(=C1C2=CC=C(C=C2)OC)O)C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C22H21NO4S/c1-4-28-22-14(2)19(16-6-5-7-17(12-16)23(25)26)13-20(24)21(22)15-8-10-18(27-3)11-9-15/h5-13,24H,4H2,1-3H3