N-[(E)-1-(3-fluorophenyl)ethylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-[(E)-1-(3-fluorophenyl)ethylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-[(E)-1-(3-fluorophenyl)ethylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[(E)-1-(3-fluorophenyl)ethylideneamino]-2-nitro-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-[(E)-1-(3-fluorophenyl)ethylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: [(E)-1-(3-fluorophenyl)ethylideneamino]-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C18H19FN4O4S MolecularWeight: 406.431263

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-])C3=CC(=CC=C3)F

Isomeric SMILES

C/C(=N\NC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-])/C3=CC(=CC=C3)F

InChI

InChI=1S/C18H19FN4O4S/c1-13(14-5-4-6-15(19)11-14)20-21-17-8-7-16(12-18(17)23(24)25)28(26,27)22-9-2-3-10-22/h4-8,11-12,21H,2-3,9-10H2,1H3/b20-13+