6-nitroso-7-[1-(phenylmethyl)sulfonylpyrrolidin-2-yl]heptanoic acid

Systemtic Name: 6-nitroso-7-[1-(phenylmethyl)sulfonylpyrrolidin-2-yl]heptanoic acid Openeye Name: 7-(1-benzylsulfonylpyrrolidin-2-yl)-6-nitroso-heptanoic acid CAS Name: 6-nitroso-7-[1-(phenylmethyl)sulfonyl-2-pyrrolidinyl]heptanoic acid IUPAC Name: 7-(1-benzylsulfonylpyrrolidin-2-yl)-6-nitrosoheptanoic acid Traditional Name: 7-(1-benzylsulfonylpyrrolidin-2-yl)-6-nitroso-enanthic acid Formula: C18H26N2O5S MolecularWeight: 382.47444

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2)CC(CCCCC(=O)O)N=O

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2)CC(CCCCC(=O)O)N=O

InChI

InChI=1S/C18H26N2O5S/c21-18(22)11-5-4-9-16(19-23)13-17-10-6-12-20(17)26(24,25)14-15-7-2-1-3-8-15/h1-3,7-8,16-17H,4-6,9-14H2,(H,21,22)