2-nitro-N-[(E)-pyridin-3-ylmethylideneamino]-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: 2-nitro-N-[(E)-pyridin-3-ylmethylideneamino]-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: 2-nitro-N-[(E)-3-pyridylmethyleneamino]-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: 2-nitro-N-[(E)-3-pyridinylmethylideneamino]-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: 2-nitro-N-[(E)-pyridin-3-ylmethylideneamino]-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: (2-nitro-4-pyrrolidinosulfonyl-phenyl)-[(E)-3-pyridylmethyleneamino]amine Formula: C16H17N5O4S MolecularWeight: 375.40228

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NN=CC3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H17N5O4S/c22-21(23)16-10-14(26(24,25)20-8-1-2-9-20)5-6-15(16)19-18-12-13-4-3-7-17-11-13/h3-7,10-12,19H,1-2,8-9H2/b18-12+