N,N-dimethyl-2-[5-(pyrrolidin-1-ylsulfonylmethyl)-1H-indol-3-yl]ethanamine; 4-oxidanylbenzoic acid

Systemtic Name: N,N-dimethyl-2-[5-(pyrrolidin-1-ylsulfonylmethyl)-1H-indol-3-yl]ethanamine; 4-oxidanylbenzoic acid Openeye Name: N,N-dimethyl-2-[5-(pyrrolidin-1-ylsulfonylmethyl)-1H-indol-3-yl]ethanamine; 4-hydroxybenzoic acid CAS Name: N,N-dimethyl-2-[5-(1-pyrrolidinylsulfonylmethyl)-1H-indol-3-yl]ethanamine; 4-hydroxybenzoic acid IUPAC Name: N,N-dimethyl-2-[5-(pyrrolidin-1-ylsulfonylmethyl)-1H-indol-3-yl]ethanamine; 4-hydroxybenzoic acid Traditional Name: dimethyl-[2-[5-(pyrrolidinosulfonylmethyl)-1H-indol-3-yl]ethyl]amine; 4-hydroxybenzoic acid Formula: C24H31N3O5S MolecularWeight: 473.58504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=CNC2=C1C=C(C=C2)CS(=O)(=O)N3CCCC3.C1=CC(=CC=C1C(=O)O)O

Isomeric SMILES

CN(C)CCC1=CNC2=C1C=C(C=C2)CS(=O)(=O)N3CCCC3.C1=CC(=CC=C1C(=O)O)O

InChI

InChI=1S/C17H25N3O2S.C7H6O3/c1-19(2)10-7-15-12-18-17-6-5-14(11-16(15)17)13-23(21,22)20-8-3-4-9-20;8-6-3-1-5(2-4-6)7(9)10/h5-6,11-12,18H,3-4,7-10,13H2,1-2H3;1-4,8H,(H,9,10)