1-(3-methoxyphenyl)-3-[4-(4-methylphenyl)sulfanyl-3-nitro-phenyl]prop-2-en-1-one

Systemtic Name: 1-(3-methoxyphenyl)-3-[4-(4-methylphenyl)sulfanyl-3-nitro-phenyl]prop-2-en-1-one Openeye Name: 1-(3-methoxyphenyl)-3-[3-nitro-4-(p-tolylsulfanyl)phenyl]prop-2-en-1-one CAS Name: 1-(3-methoxyphenyl)-3-[4-[(4-methylphenyl)thio]-3-nitrophenyl]-2-propen-1-one IUPAC Name: 1-(3-methoxyphenyl)-3-[4-(4-methylphenyl)sulfanyl-3-nitrophenyl]prop-2-en-1-one Traditional Name: 1-(3-methoxyphenyl)-3-[3-nitro-4-(p-tolylthio)phenyl]prop-2-en-1-one Formula: C23H19NO4S MolecularWeight: 405.46626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C=CC(=O)C3=CC(=CC=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C=CC(=O)C3=CC(=CC=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H19NO4S/c1-16-6-10-20(11-7-16)29-23-13-9-17(14-21(23)24(26)27)8-12-22(25)18-4-3-5-19(15-18)28-2/h3-15H,1-2H3