[4-methoxy-2-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]oxy-phenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-methoxy-2-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]oxy-phenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-methoxy-2-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]oxy-phenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-methoxy-2-[[1-(3-pyridinylmethyl)-4-piperidin-1-iumyl]oxy]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-methoxy-2-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-methoxy-2-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]oxy-phenyl]-pyrrolidino-methanone Formula: C23H30N3O3+ MolecularWeight: 396.5026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)N2CCCC2)OC3CC[NH+](CC3)CC4=CN=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)N2CCCC2)OC3CC[NH+](CC3)CC4=CN=CC=C4

InChI

InChI=1S/C23H29N3O3/c1-28-20-6-7-21(23(27)26-11-2-3-12-26)22(15-20)29-19-8-13-25(14-9-19)17-18-5-4-10-24-16-18/h4-7,10,15-16,19H,2-3,8-9,11-14,17H2,1H3/p+1