N-[2-(4-chloranylphenoxy)ethyl]-4-nitro-2-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-[2-(4-chloranylphenoxy)ethyl]-4-nitro-2-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-[2-(4-chlorophenoxy)ethyl]-4-nitro-2-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[2-(4-chlorophenoxy)ethyl]-4-nitro-2-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-[2-(4-chlorophenoxy)ethyl]-4-nitro-2-pyrrolidin-1-ylsulfonylaniline Traditional Name: 2-(4-chlorophenoxy)ethyl-(4-nitro-2-pyrrolidinosulfonyl-phenyl)amine Formula: C18H20ClN3O5S MolecularWeight: 425.8865

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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=C(C=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClN3O5S/c19-14-3-6-16(7-4-14)27-12-9-20-17-8-5-15(22(23)24)13-18(17)28(25,26)21-10-1-2-11-21/h3-8,13,20H,1-2,9-12H2