methyl 4-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]butanoate

Systemtic Name: methyl 4-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]butanoate Openeye Name: methyl 4-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]butanoate CAS Name: 4-[[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]butanoate Traditional Name: 4-[(4-pyrrolidinosulfonylbenzoyl)amino]butyric acid methyl ester Formula: C16H22N2O5S MolecularWeight: 354.42128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O5S/c1-23-15(19)5-4-10-17-16(20)13-6-8-14(9-7-13)24(21,22)18-11-2-3-12-18/h6-9H,2-5,10-12H2,1H3,(H,17,20)