methyl 6-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]hexanoate

Systemtic Name: methyl 6-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]hexanoate Openeye Name: methyl 6-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]hexanoate CAS Name: 6-[[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]hexanoate Traditional Name: 6-[(4-pyrrolidinosulfonylbenzoyl)amino]hexanoic acid methyl ester Formula: C18H26N2O5S MolecularWeight: 382.47444

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

COC(=O)CCCCCNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C18H26N2O5S/c1-25-17(21)7-3-2-4-12-19-18(22)15-8-10-16(11-9-15)26(23,24)20-13-5-6-14-20/h8-11H,2-7,12-14H2,1H3,(H,19,22)