1-phenethyl-3-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]urea

Systemtic Name: 1-phenethyl-3-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]urea Openeye Name: 1-phenethyl-3-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]urea CAS Name: 1-phenethyl-3-[[6-(1-pyrrolidinyl)-3-pyridin-1-iumyl]methyl]urea IUPAC Name: 1-phenethyl-3-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]urea Traditional Name: 1-phenethyl-3-[(6-pyrrolidinopyridin-1-ium-3-yl)methyl]urea Formula: C19H25N4O+ MolecularWeight: 325.428

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=[NH+]C=C(C=C2)CNC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)C2=[NH+]C=C(C=C2)CNC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C19H24N4O/c24-19(20-11-10-16-6-2-1-3-7-16)22-15-17-8-9-18(21-14-17)23-12-4-5-13-23/h1-3,6-9,14H,4-5,10-13,15H2,(H2,20,22,24)/p+1