4-(benzotriazol-1-ylmethyl)-N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide

Systemtic Name: 4-(benzotriazol-1-ylmethyl)-N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Openeye Name: 4-(benzotriazol-1-ylmethyl)-N-[(2R)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide CAS Name: 4-(1-benzotriazolylmethyl)-N-[(2R)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]benzamide IUPAC Name: 4-(benzotriazol-1-ylmethyl)-N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]benzamide Traditional Name: 4-(benzotriazol-1-ylmethyl)-N-[(2R)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Formula: C24H26N5O2+ MolecularWeight: 416.49554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3)C5=CC=CO5

Isomeric SMILES

C1CC[NH+](C1)[C@H](CNC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3)C5=CC=CO5

InChI

InChI=1S/C24H25N5O2/c30-24(25-16-22(23-8-5-15-31-23)28-13-3-4-14-28)19-11-9-18(10-12-19)17-29-21-7-2-1-6-20(21)26-27-29/h1-2,5-12,15,22H,3-4,13-14,16-17H2,(H,25,30)/p+1/t22-/m1/s1