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

Systemtic Name: (2R)-N-[4-(1,3-benzoxazol-2-yl)phenyl]-1-cyclobutyl-pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R)-N-[4-(1,3-benzoxazol-2-yl)phenyl]-1-cyclobutyl-pyrrolidin-1-ium-2-carboxamide CAS Name: (2R)-N-[4-(1,3-benzoxazol-2-yl)phenyl]-1-cyclobutyl-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R)-N-[4-(1,3-benzoxazol-2-yl)phenyl]-1-cyclobutylpyrrolidin-1-ium-2-carboxamide Traditional Name: (2R)-N-[4-(1,3-benzoxazol-2-yl)phenyl]-1-cyclobutyl-pyrrolidin-1-ium-2-carboxamide Formula: C22H24N3O2+ MolecularWeight: 362.44486

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)[NH+]2CCCC2C(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

C1C[C@@H]([NH+](C1)C2CCC2)C(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C22H23N3O2/c26-21(19-8-4-14-25(19)17-5-3-6-17)23-16-12-10-15(11-13-16)22-24-18-7-1-2-9-20(18)27-22/h1-2,7,9-13,17,19H,3-6,8,14H2,(H,23,26)/p+1/t19-/m1/s1