1-(4-pyridin-3-ylbutyl)pyrrolidine-3-sulfinic acid

Systemtic Name: 1-(4-pyridin-3-ylbutyl)pyrrolidine-3-sulfinic acid Openeye Name: 1-[4-(3-pyridyl)butyl]pyrrolidine-3-sulfinic acid CAS Name: 1-[4-(3-pyridinyl)butyl]-3-pyrrolidinesulfinic acid IUPAC Name: 1-(4-pyridin-3-ylbutyl)pyrrolidine-3-sulfinic acid Traditional Name: 1-[4-(3-pyridyl)butyl]pyrrolidine-3-sulfinic acid Formula: C13H20N2O2S MolecularWeight: 268.3751

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1S(=O)O)CCCCC2=CN=CC=C2

Isomeric SMILES

C1CN(CC1S(=O)O)CCCCC2=CN=CC=C2

InChI

InChI=1S/C13H20N2O2S/c16-18(17)13-6-9-15(11-13)8-2-1-4-12-5-3-7-14-10-12/h3,5,7,10,13H,1-2,4,6,8-9,11H2,(H,16,17)