[(1R)-2-methyl-1-phenyl-propyl]-[2-oxidanylidene-2-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]azanium

Systemtic Name: [(1R)-2-methyl-1-phenyl-propyl]-[2-oxidanylidene-2-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]azanium Openeye Name: [(1R)-2-methyl-1-phenyl-propyl]-[2-oxo-2-(4-pyrrolidin-1-ylsulfonylanilino)ethyl]ammonium CAS Name: [(1R)-2-methyl-1-phenylpropyl]-[2-oxo-2-[4-(1-pyrrolidinylsulfonyl)anilino]ethyl]ammonium IUPAC Name: [(1R)-2-methyl-1-phenylpropyl]-[2-oxo-2-(4-pyrrolidin-1-ylsulfonylanilino)ethyl]azanium Traditional Name: [2-keto-2-(4-pyrrolidinosulfonylanilino)ethyl]-[(1R)-2-methyl-1-phenyl-propyl]ammonium Formula: C22H30N3O3S+ MolecularWeight: 416.5569

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CC=C1)[NH2+]CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC(C)[C@H](C1=CC=CC=C1)[NH2+]CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H29N3O3S/c1-17(2)22(18-8-4-3-5-9-18)23-16-21(26)24-19-10-12-20(13-11-19)29(27,28)25-14-6-7-15-25/h3-5,8-13,17,22-23H,6-7,14-16H2,1-2H3,(H,24,26)/p+1/t22-/m1/s1