N-[4-(3-methylbutanoylamino)phenyl]sulfonylbutanimidate

Systemtic Name: N-[4-(3-methylbutanoylamino)phenyl]sulfonylbutanimidate Openeye Name: N-[4-(3-methylbutanoylamino)phenyl]sulfonylbutanimidate CAS Name: N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]sulfonylbutanimidate IUPAC Name: N-[4-(3-methylbutanoylamino)phenyl]sulfonylbutanimidate Traditional Name: N-[4-(isovalerylamino)phenyl]sulfonylbutyrimidate Formula: C15H21N2O4S- MolecularWeight: 325.40324

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NS(=O)(=O)C1=CC=C(C=C1)NC(=O)CC(C)C)[O-]

Isomeric SMILES

CCCC(=NS(=O)(=O)C1=CC=C(C=C1)NC(=O)CC(C)C)[O-]

InChI

InChI=1S/C15H22N2O4S/c1-4-5-14(18)17-22(20,21)13-8-6-12(7-9-13)16-15(19)10-11(2)3/h6-9,11H,4-5,10H2,1-3H3,(H,16,19)(H,17,18)/p-1