4-[(4-butylphenyl)methyl-methylsulfonyl-amino]butyl hydrogen carbonate

Systemtic Name: 4-[(4-butylphenyl)methyl-methylsulfonyl-amino]butyl hydrogen carbonate Openeye Name: 4-[(4-butylphenyl)methyl-methylsulfonyl-amino]butyl hydrogen carbonate CAS Name: carbonic acid 4-[(4-butylphenyl)methyl-methylsulfonylamino]butyl ester IUPAC Name: 4-[(4-butylphenyl)methyl-methylsulfonylamino]butyl hydrogen carbonate Traditional Name: carbonic acid 4-[(4-butylbenzyl)-mesyl-amino]butyl ester Formula: C17H27NO5S MolecularWeight: 357.46498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CN(CCCCOC(=O)O)S(=O)(=O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)CN(CCCCOC(=O)O)S(=O)(=O)C

InChI

InChI=1S/C17H27NO5S/c1-3-4-7-15-8-10-16(11-9-15)14-18(24(2,21)22)12-5-6-13-23-17(19)20/h8-11H,3-7,12-14H2,1-2H3,(H,19,20)