hexadecanoate; N-[4-[1-oxidanyl-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide

Systemtic Name: hexadecanoate; N-[4-[1-oxidanyl-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide Openeye Name: hexadecanoate; N-[4-[1-hydroxy-2-(isopropylamino)ethyl]phenyl]methanesulfonamide CAS Name: hexadecanoate; N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide IUPAC Name: hexadecanoate; N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide Traditional Name: N-[4-[1-hydroxy-2-(isopropylamino)ethyl]phenyl]methanesulfonamide; palmitate Formula: C28H51N2O5S- MolecularWeight: 527.77994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)[O-].CC(C)NCC(C1=CC=C(C=C1)NS(=O)(=O)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)[O-].CC(C)NCC(C1=CC=C(C=C1)NS(=O)(=O)C)O

InChI

InChI=1S/C16H32O2.C12H20N2O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18;1-9(2)13-8-12(15)10-4-6-11(7-5-10)14-18(3,16)17/h2-15H2,1H3,(H,17,18);4-7,9,12-15H,8H2,1-3H3/p-1