cyclopentyl-dimethyl-[(2R)-1-oxidanylidene-1-[(4-phenylmethoxyphenyl)amino]propan-2-yl]azanium

Systemtic Name: cyclopentyl-dimethyl-[(2R)-1-oxidanylidene-1-[(4-phenylmethoxyphenyl)amino]propan-2-yl]azanium Openeye Name: [(1R)-2-(4-benzyloxyanilino)-1-methyl-2-oxo-ethyl]-cyclopentyl-dimethyl-ammonium CAS Name: cyclopentyl-dimethyl-[(2R)-1-oxo-1-(4-phenylmethoxyanilino)propan-2-yl]ammonium IUPAC Name: cyclopentyl-dimethyl-[(2R)-1-oxo-1-(4-phenylmethoxyanilino)propan-2-yl]azanium Traditional Name: [(1R)-2-(4-benzoxyanilino)-2-keto-1-methyl-ethyl]-cyclopentyl-dimethyl-ammonium Formula: C23H31N2O2+ MolecularWeight: 367.50444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)[N+](C)(C)C3CCCC3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)[N+](C)(C)C3CCCC3

InChI

InChI=1S/C23H30N2O2/c1-18(25(2,3)21-11-7-8-12-21)23(26)24-20-13-15-22(16-14-20)27-17-19-9-5-4-6-10-19/h4-6,9-10,13-16,18,21H,7-8,11-12,17H2,1-3H3/p+1/t18-/m1/s1