1-[(1S)-1-(4-chlorophenyl)ethyl]-3-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]urea

Systemtic Name: 1-[(1S)-1-(4-chlorophenyl)ethyl]-3-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]urea Openeye Name: 1-[(1S)-1-(4-chlorophenyl)ethyl]-3-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]urea CAS Name: 1-[(1S)-1-(4-chlorophenyl)ethyl]-3-[[2-(1-pyrrolidinyl)-4-pyridin-1-iumyl]methyl]urea IUPAC Name: 1-[(1S)-1-(4-chlorophenyl)ethyl]-3-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]urea Traditional Name: 1-[(1S)-1-(4-chlorophenyl)ethyl]-3-[(2-pyrrolidinopyridin-1-ium-4-yl)methyl]urea Formula: C19H24ClN4O+ MolecularWeight: 359.87306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Cl)NC(=O)NCC2=CC(=[NH+]C=C2)N3CCCC3

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)Cl)NC(=O)NCC2=CC(=[NH+]C=C2)N3CCCC3

InChI

InChI=1S/C19H23ClN4O/c1-14(16-4-6-17(20)7-5-16)23-19(25)22-13-15-8-9-21-18(12-15)24-10-2-3-11-24/h4-9,12,14H,2-3,10-11,13H2,1H3,(H2,22,23,25)/p+1/t14-/m0/s1