N-[(1R)-1-(3-fluorophenyl)ethyl]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-[(1R)-1-(3-fluorophenyl)ethyl]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-[(1R)-1-(3-fluorophenyl)ethyl]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[(1R)-1-(3-fluorophenyl)ethyl]-2-nitro-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-[(1R)-1-(3-fluorophenyl)ethyl]-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: [(1R)-1-(3-fluorophenyl)ethyl]-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C18H20FN3O4S MolecularWeight: 393.432503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)F)NC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C18H20FN3O4S/c1-13(14-5-4-6-15(19)11-14)20-17-8-7-16(12-18(17)22(23)24)27(25,26)21-9-2-3-10-21/h4-8,11-13,20H,2-3,9-10H2,1H3/t13-/m1/s1