2-bromanyl-N-methyl-N-[(2-nitrophenyl)methyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-bromanyl-N-methyl-N-[(2-nitrophenyl)methyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-N-methyl-N-[(2-nitrophenyl)methyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-bromo-N-methyl-N-[(2-nitrophenyl)methyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-methyl-N-[(2-nitrophenyl)methyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-N-methyl-N-(2-nitrobenzyl)-5-pyrrolidinosulfonyl-benzamide Formula: C19H20BrN3O5S MolecularWeight: 482.3482

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1[N+](=O)[O-])C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Br

Isomeric SMILES

CN(CC1=CC=CC=C1[N+](=O)[O-])C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Br

InChI

InChI=1S/C19H20BrN3O5S/c1-21(13-14-6-2-3-7-18(14)23(25)26)19(24)16-12-15(8-9-17(16)20)29(27,28)22-10-4-5-11-22/h2-3,6-9,12H,4-5,10-11,13H2,1H3