sodium (1E)-N-[2,6-di(propan-2-yl)phenoxy]sulfonyl-3-methyl-2-phenyl-pentanimidate

Systemtic Name: sodium (1E)-N-[2,6-di(propan-2-yl)phenoxy]sulfonyl-3-methyl-2-phenyl-pentanimidate Openeye Name: sodium (1E)-N-(2,6-diisopropylphenoxy)sulfonyl-3-methyl-2-phenyl-pentanimidate CAS Name: sodium (1E)-N-[2,6-di(propan-2-yl)phenoxy]sulfonyl-3-methyl-2-phenylpentanimidate IUPAC Name: sodium (1E)-N-[2,6-di(propan-2-yl)phenoxy]sulfonyl-3-methyl-2-phenylpentanimidate Traditional Name: sodium (1E)-N-(2,6-diisopropylphenoxy)sulfonyl-3-methyl-2-phenyl-valerimidate Formula: C24H32NNaO4S MolecularWeight: 453.56995

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1=CC=CC=C1)C(=NS(=O)(=O)OC2=C(C=CC=C2C(C)C)C(C)C)[O-].[Na+]

Isomeric SMILES

CCC(C)C(C1=CC=CC=C1)/C(=N\S(=O)(=O)OC2=C(C=CC=C2C(C)C)C(C)C)/[O-].[Na+]

InChI

InChI=1S/C24H33NO4S.Na/c1-7-18(6)22(19-12-9-8-10-13-19)24(26)25-30(27,28)29-23-20(16(2)3)14-11-15-21(23)17(4)5;/h8-18,22H,7H2,1-6H3,(H,25,26);/q;+1/p-1