(2R)-N-[4-(1,3-benzoxazol-2-yl)phenyl]-1-(1H-imidazol-2-ylmethyl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2R)-N-[4-(1,3-benzoxazol-2-yl)phenyl]-1-(1H-imidazol-2-ylmethyl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R)-N-[4-(1,3-benzoxazol-2-yl)phenyl]-1-(1H-imidazol-2-ylmethyl)pyrrolidin-1-ium-2-carboxamide CAS Name: (2R)-N-[4-(1,3-benzoxazol-2-yl)phenyl]-1-(1H-imidazol-2-ylmethyl)-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R)-N-[4-(1,3-benzoxazol-2-yl)phenyl]-1-(1H-imidazol-2-ylmethyl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2R)-N-[4-(1,3-benzoxazol-2-yl)phenyl]-1-(1H-imidazol-2-ylmethyl)pyrrolidin-1-ium-2-carboxamide Formula: C22H22N5O2+ MolecularWeight: 388.44238

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC2=NC=CN2)C(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

C1C[C@@H]([NH+](C1)CC2=NC=CN2)C(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C22H21N5O2/c28-21(18-5-3-13-27(18)14-20-23-11-12-24-20)25-16-9-7-15(8-10-16)22-26-17-4-1-2-6-19(17)29-22/h1-2,4,6-12,18H,3,5,13-14H2,(H,23,24)(H,25,28)/p+1/t18-/m1/s1