N-(2-chloranyl-4-nitro-phenyl)-4-ethoxy-3-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-(2-chloranyl-4-nitro-phenyl)-4-ethoxy-3-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-(2-chloro-4-nitro-phenyl)-4-ethoxy-3-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-(2-chloro-4-nitrophenyl)-4-ethoxy-3-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-(2-chloro-4-nitrophenyl)-4-ethoxy-3-pyrrolidin-1-ylsulfonylaniline Traditional Name: (2-chloro-4-nitro-phenyl)-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)amine Formula: C18H20ClN3O5S MolecularWeight: 425.8865

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H20ClN3O5S/c1-2-27-17-8-5-13(11-18(17)28(25,26)21-9-3-4-10-21)20-16-7-6-14(22(23)24)12-15(16)19/h5-8,11-12,20H,2-4,9-10H2,1H3