6-[[2-[3-(methoxymethoxy)pyrrolidin-1-yl]-1-phenyl-ethyl]-methyl-amino]pyridine-3-carboxylic acid

Systemtic Name: 6-[[2-[3-(methoxymethoxy)pyrrolidin-1-yl]-1-phenyl-ethyl]-methyl-amino]pyridine-3-carboxylic acid Openeye Name: 6-[[2-[3-(methoxymethoxy)pyrrolidin-1-yl]-1-phenyl-ethyl]-methyl-amino]pyridine-3-carboxylic acid CAS Name: 6-[[2-[3-(methoxymethoxy)-1-pyrrolidinyl]-1-phenylethyl]-methylamino]-3-pyridinecarboxylic acid IUPAC Name: 6-[[2-[3-(methoxymethoxy)pyrrolidin-1-yl]-1-phenylethyl]-methylamino]pyridine-3-carboxylic acid Traditional Name: 6-[[2-[3-(methoxymethoxy)pyrrolidino]-1-phenyl-ethyl]-methyl-amino]nicotinic acid Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=NC=C(C=C1)C(=O)O)C(CN2CCC(C2)OCOC)C3=CC=CC=C3

Isomeric SMILES

CN(C1=NC=C(C=C1)C(=O)O)C(CN2CCC(C2)OCOC)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O4/c1-23(20-9-8-17(12-22-20)21(25)26)19(16-6-4-3-5-7-16)14-24-11-10-18(13-24)28-15-27-2/h3-9,12,18-19H,10-11,13-15H2,1-2H3,(H,25,26)