2-[[(2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoyl]amino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[[(2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoyl]amino]ethyl-di(propan-2-yl)azanium Openeye Name: diisopropyl-[2-[[(2S)-3-methyl-2-(2-naphthylsulfonylamino)butanoyl]amino]ethyl]ammonium CAS Name: 2-[[(2S)-3-methyl-2-(2-naphthalenylsulfonylamino)-1-oxobutyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[(2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: diisopropyl-[2-[[(2S)-3-methyl-2-(2-naphthylsulfonylamino)butanoyl]amino]ethyl]ammonium Formula: C23H36N3O3S+ MolecularWeight: 434.61524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC[NH+](C(C)C)C(C)C)NS(=O)(=O)C1=CC2=CC=CC=C2C=C1

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC[NH+](C(C)C)C(C)C)NS(=O)(=O)C1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C23H35N3O3S/c1-16(2)22(23(27)24-13-14-26(17(3)4)18(5)6)25-30(28,29)21-12-11-19-9-7-8-10-20(19)15-21/h7-12,15-18,22,25H,13-14H2,1-6H3,(H,24,27)/p+1/t22-/m0/s1