3-azanyl-1-chloranyl-4-[4-(4-methylphenyl)sulfonylphenyl]butan-2-one

Systemtic Name: 3-azanyl-1-chloranyl-4-[4-(4-methylphenyl)sulfonylphenyl]butan-2-one Openeye Name: 3-amino-1-chloro-4-[4-(p-tolylsulfonyl)phenyl]butan-2-one CAS Name: 3-amino-1-chloro-4-[4-(4-methylphenyl)sulfonylphenyl]-2-butanone IUPAC Name: 3-amino-1-chloro-4-[4-(4-methylphenyl)sulfonylphenyl]butan-2-one Traditional Name: 3-amino-1-chloro-4-(4-tosylphenyl)butan-2-one Formula: C17H18ClNO3S MolecularWeight: 351.84772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)CC(C(=O)CCl)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)CC(C(=O)CCl)N

InChI

InChI=1S/C17H18ClNO3S/c1-12-2-6-14(7-3-12)23(21,22)15-8-4-13(5-9-15)10-16(19)17(20)11-18/h2-9,16H,10-11,19H2,1H3