[1-(hexylamino)-2-methyl-propan-2-yl] benzoate; sulfuric acid

Systemtic Name: [1-(hexylamino)-2-methyl-propan-2-yl] benzoate; sulfuric acid Openeye Name: [2-(hexylamino)-1,1-dimethyl-ethyl] benzoate; sulfuric acid CAS Name: benzoic acid [1-(hexylamino)-2-methylpropan-2-yl] ester; sulfuric acid IUPAC Name: [1-(hexylamino)-2-methylpropan-2-yl] benzoate; sulfuric acid Traditional Name: benzoic acid [2-(hexylamino)-1,1-dimethyl-ethyl] ester; sulfuric acid Formula: C17H29NO6S MolecularWeight: 375.48026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNCC(C)(C)OC(=O)C1=CC=CC=C1.OS(=O)(=O)O

Isomeric SMILES

CCCCCCNCC(C)(C)OC(=O)C1=CC=CC=C1.OS(=O)(=O)O

InChI

InChI=1S/C17H27NO2.H2O4S/c1-4-5-6-10-13-18-14-17(2,3)20-16(19)15-11-8-7-9-12-15;1-5(2,3)4/h7-9,11-12,18H,4-6,10,13-14H2,1-3H3;(H2,1,2,3,4)