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

Systemtic Name: 2-bromanyl-N-[2-[(2-nitrophenyl)amino]ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-N-[2-(2-nitroanilino)ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-bromo-N-[2-(2-nitroanilino)ethyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-[2-(2-nitroanilino)ethyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-N-[2-(2-nitroanilino)ethyl]-5-pyrrolidinosulfonyl-benzamide Formula: C19H21BrN4O5S MolecularWeight: 497.36284

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NCCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NCCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H21BrN4O5S/c20-16-8-7-14(30(28,29)23-11-3-4-12-23)13-15(16)19(25)22-10-9-21-17-5-1-2-6-18(17)24(26)27/h1-2,5-8,13,21H,3-4,9-12H2,(H,22,25)