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

Systemtic Name: methyl-(naphthalen-2-ylmethyl)-[2-oxidanylidene-2-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]amino]ethyl]azanium Openeye Name: methyl-(2-naphthylmethyl)-[2-oxo-2-[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]ethyl]ammonium CAS Name: methyl-(2-naphthalenylmethyl)-[2-oxo-2-[4-(1-pyrrolidin-1-iumylmethyl)anilino]ethyl]ammonium IUPAC Name: methyl-(naphthalen-2-ylmethyl)-[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]-methyl-(2-naphthylmethyl)ammonium Formula: C25H31N3O+2 MolecularWeight: 389.53314

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC2=CC=CC=C2C=C1)CC(=O)NC3=CC=C(C=C3)C[NH+]4CCCC4

Isomeric SMILES

C[NH+](CC1=CC2=CC=CC=C2C=C1)CC(=O)NC3=CC=C(C=C3)C[NH+]4CCCC4

InChI

InChI=1S/C25H29N3O/c1-27(17-21-8-11-22-6-2-3-7-23(22)16-21)19-25(29)26-24-12-9-20(10-13-24)18-28-14-4-5-15-28/h2-3,6-13,16H,4-5,14-15,17-19H2,1H3,(H,26,29)/p+2