4-nitro-N-(2-phenoxyethyl)-2-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: 4-nitro-N-(2-phenoxyethyl)-2-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: 4-nitro-N-(2-phenoxyethyl)-2-pyrrolidin-1-ylsulfonyl-aniline CAS Name: 4-nitro-N-(2-phenoxyethyl)-2-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: 4-nitro-N-(2-phenoxyethyl)-2-pyrrolidin-1-ylsulfonylaniline Traditional Name: (4-nitro-2-pyrrolidinosulfonyl-phenyl)-(2-phenoxyethyl)amine Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCOC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCOC3=CC=CC=C3

InChI

InChI=1S/C18H21N3O5S/c22-21(23)15-8-9-17(19-10-13-26-16-6-2-1-3-7-16)18(14-15)27(24,25)20-11-4-5-12-20/h1-3,6-9,14,19H,4-5,10-13H2