2-bromanyl-N-phenylmethoxy-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-bromanyl-N-phenylmethoxy-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-benzyloxy-2-bromo-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-bromo-N-phenylmethoxy-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-phenylmethoxy-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-benzoxy-2-bromo-5-pyrrolidinosulfonyl-benzamide Formula: C18H19BrN2O4S MolecularWeight: 439.32346

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NOCC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NOCC3=CC=CC=C3

InChI

InChI=1S/C18H19BrN2O4S/c19-17-9-8-15(26(23,24)21-10-4-5-11-21)12-16(17)18(22)20-25-13-14-6-2-1-3-7-14/h1-3,6-9,12H,4-5,10-11,13H2,(H,20,22)