methyl 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-7-cyclohexyl-heptyl]phenyl]butanoate

Systemtic Name: methyl 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-7-cyclohexyl-heptyl]phenyl]butanoate Openeye Name: methyl 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-7-cyclohexyl-heptyl]phenyl]butanoate CAS Name: 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-7-cyclohexylheptyl]phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-7-cyclohexylheptyl]phenyl]butanoate Traditional Name: 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-7-cyclohexyl-heptyl]phenyl]butyric acid methyl ester Formula: C30H42ClNO4S MolecularWeight: 548.17678

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1=CC=C(C=C1)C(CCCCCCC2CCCCC2)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)CCCC1=CC=C(C=C1)C(CCCCCCC2CCCCC2)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C30H42ClNO4S/c1-36-30(33)15-9-13-25-16-18-26(19-17-25)29(32-37(34,35)28-22-20-27(31)21-23-28)14-8-3-2-5-10-24-11-6-4-7-12-24/h16-24,29,32H,2-15H2,1H3