[(2R)-1-oxidanylidene-1-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]propan-2-yl]-[(1R)-1-phenylethyl]azanium

Systemtic Name: [(2R)-1-oxidanylidene-1-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]propan-2-yl]-[(1R)-1-phenylethyl]azanium Openeye Name: [(1R)-1-methyl-2-oxo-2-(4-pyrrolidin-1-ylsulfonylanilino)ethyl]-[(1R)-1-phenylethyl]ammonium CAS Name: [(2R)-1-oxo-1-[4-(1-pyrrolidinylsulfonyl)anilino]propan-2-yl]-[(1R)-1-phenylethyl]ammonium IUPAC Name: [(2R)-1-oxo-1-(4-pyrrolidin-1-ylsulfonylanilino)propan-2-yl]-[(1R)-1-phenylethyl]azanium Traditional Name: [(1R)-2-keto-1-methyl-2-(4-pyrrolidinosulfonylanilino)ethyl]-[(1R)-1-phenylethyl]ammonium Formula: C21H28N3O3S+ MolecularWeight: 402.53032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O3S/c1-16(18-8-4-3-5-9-18)22-17(2)21(25)23-19-10-12-20(13-11-19)28(26,27)24-14-6-7-15-24/h3-5,8-13,16-17,22H,6-7,14-15H2,1-2H3,(H,23,25)/p+1/t16-,17-/m1/s1