4-methoxy-3-nitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide

Systemtic Name: 4-methoxy-3-nitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Openeye Name: 4-methoxy-3-nitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide CAS Name: 4-methoxy-3-nitro-N-[4-(1-pyrrolidinylsulfonyl)phenyl]benzamide IUPAC Name: 4-methoxy-3-nitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Traditional Name: 4-methoxy-3-nitro-N-(4-pyrrolidinosulfonylphenyl)benzamide Formula: C18H19N3O6S MolecularWeight: 405.42496

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O6S/c1-27-17-9-4-13(12-16(17)21(23)24)18(22)19-14-5-7-15(8-6-14)28(25,26)20-10-2-3-11-20/h4-9,12H,2-3,10-11H2,1H3,(H,19,22)