[2-[(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-[(1R)-1-phenylethyl]azanium

Systemtic Name: [2-[(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-[(1R)-1-phenylethyl]azanium Openeye Name: [2-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-anilino)-2-oxo-ethyl]-[(1R)-1-phenylethyl]ammonium CAS Name: [2-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)anilino]-2-oxoethyl]-[(1R)-1-phenylethyl]ammonium IUPAC Name: [2-(4-ethoxy-3-pyrrolidin-1-ylsulfonylanilino)-2-oxoethyl]-[(1R)-1-phenylethyl]azanium Traditional Name: [2-(4-ethoxy-3-pyrrolidinosulfonyl-anilino)-2-keto-ethyl]-[(1R)-1-phenylethyl]ammonium Formula: C22H30N3O4S+ MolecularWeight: 432.5563

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C[NH2+]C(C)C2=CC=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C[NH2+][C@H](C)C2=CC=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H29N3O4S/c1-3-29-20-12-11-19(15-21(20)30(27,28)25-13-7-8-14-25)24-22(26)16-23-17(2)18-9-5-4-6-10-18/h4-6,9-12,15,17,23H,3,7-8,13-14,16H2,1-2H3,(H,24,26)/p+1/t17-/m1/s1