1-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-phenyl-urea

Systemtic Name: 1-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-phenyl-urea Openeye Name: 1-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-phenyl-urea CAS Name: 1-[(2R)-2-(3-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3-phenylurea IUPAC Name: 1-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-3-phenylurea Traditional Name: 1-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-phenyl-urea Formula: C20H26N3O2+ MolecularWeight: 340.43934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)NC2=CC=CC=C2)[NH+]3CCCC3

Isomeric SMILES

COC1=CC=CC(=C1)[C@H](CNC(=O)NC2=CC=CC=C2)[NH+]3CCCC3

InChI

InChI=1S/C20H25N3O2/c1-25-18-11-7-8-16(14-18)19(23-12-5-6-13-23)15-21-20(24)22-17-9-3-2-4-10-17/h2-4,7-11,14,19H,5-6,12-13,15H2,1H3,(H2,21,22,24)/p+1/t19-/m0/s1