4-chloranyl-1-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]butan-1-one

Systemtic Name: 4-chloranyl-1-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]butan-1-one Openeye Name: 4-chloro-1-[1-(p-tolylsulfonyl)pyrrol-3-yl]butan-1-one CAS Name: 4-chloro-1-[1-(4-methylphenyl)sulfonyl-3-pyrrolyl]-1-butanone IUPAC Name: 4-chloro-1-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]butan-1-one Traditional Name: 4-chloro-1-(1-tosylpyrrol-3-yl)butan-1-one Formula: C15H16ClNO3S MolecularWeight: 325.81044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)C(=O)CCCCl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)C(=O)CCCCl

InChI

InChI=1S/C15H16ClNO3S/c1-12-4-6-14(7-5-12)21(19,20)17-10-8-13(11-17)15(18)3-2-9-16/h4-8,10-11H,2-3,9H2,1H3