methyl 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-3-methyl-butyl]phenyl]butanoate

Systemtic Name: methyl 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-3-methyl-butyl]phenyl]butanoate Openeye Name: methyl 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-3-methyl-butyl]phenyl]butanoate CAS Name: 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-3-methylbutyl]phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-3-methylbutyl]phenyl]butanoate Traditional Name: 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-3-methyl-butyl]phenyl]butyric acid methyl ester Formula: C22H28ClNO4S MolecularWeight: 437.98002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=C(C=C1)CCCC(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)CC(C1=CC=C(C=C1)CCCC(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C22H28ClNO4S/c1-16(2)15-21(24-29(26,27)20-13-11-19(23)12-14-20)18-9-7-17(8-10-18)5-4-6-22(25)28-3/h7-14,16,21,24H,4-6,15H2,1-3H3