(3-methoxyphenyl)methyl-methyl-[2-oxidanylidene-2-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]amino]ethyl]azanium

Systemtic Name: (3-methoxyphenyl)methyl-methyl-[2-oxidanylidene-2-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]amino]ethyl]azanium Openeye Name: (3-methoxyphenyl)methyl-methyl-[2-oxo-2-[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]ethyl]ammonium CAS Name: (3-methoxyphenyl)methyl-methyl-[2-oxo-2-[4-(1-pyrrolidin-1-iumylmethyl)anilino]ethyl]ammonium IUPAC Name: (3-methoxyphenyl)methyl-methyl-[2-oxo-2-[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]ethyl]azanium Traditional Name: [2-keto-2-[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]ethyl]-m-anisyl-methyl-ammonium Formula: C22H31N3O2+2 MolecularWeight: 369.50044

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=CC=C1)OC)CC(=O)NC2=CC=C(C=C2)C[NH+]3CCCC3

Isomeric SMILES

C[NH+](CC1=CC(=CC=C1)OC)CC(=O)NC2=CC=C(C=C2)C[NH+]3CCCC3

InChI

InChI=1S/C22H29N3O2/c1-24(15-19-6-5-7-21(14-19)27-2)17-22(26)23-20-10-8-18(9-11-20)16-25-12-3-4-13-25/h5-11,14H,3-4,12-13,15-17H2,1-2H3,(H,23,26)/p+2