5-chloranyl-2-methoxy-N-[1-(quinolin-4-ylmethyl)pyrrolidin-3-yl]benzenesulfonamide

Systemtic Name: 5-chloranyl-2-methoxy-N-[1-(quinolin-4-ylmethyl)pyrrolidin-3-yl]benzenesulfonamide Openeye Name: 5-chloro-2-methoxy-N-[1-(4-quinolylmethyl)pyrrolidin-3-yl]benzenesulfonamide CAS Name: 5-chloro-2-methoxy-N-[1-(4-quinolinylmethyl)-3-pyrrolidinyl]benzenesulfonamide IUPAC Name: 5-chloro-2-methoxy-N-[1-(quinolin-4-ylmethyl)pyrrolidin-3-yl]benzenesulfonamide Traditional Name: 5-chloro-2-methoxy-N-[1-(4-quinolylmethyl)pyrrolidin-3-yl]benzenesulfonamide Formula: C21H22ClN3O3S MolecularWeight: 431.93568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)S(=O)(=O)NC2CCN(C2)CC3=CC=NC4=CC=CC=C34

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)S(=O)(=O)NC2CCN(C2)CC3=CC=NC4=CC=CC=C34

InChI

InChI=1S/C21H22ClN3O3S/c1-28-20-7-6-16(22)12-21(20)29(26,27)24-17-9-11-25(14-17)13-15-8-10-23-19-5-3-2-4-18(15)19/h2-8,10,12,17,24H,9,11,13-14H2,1H3