[1-[2-[4-(4-cyanophenyl)phenoxy]ethyl]pyrrolidin-1-ium-1-yl]carbamic acid

Systemtic Name: [1-[2-[4-(4-cyanophenyl)phenoxy]ethyl]pyrrolidin-1-ium-1-yl]carbamic acid Openeye Name: [1-[2-[4-(4-cyanophenyl)phenoxy]ethyl]pyrrolidin-1-ium-1-yl]carbamic acid CAS Name: [1-[2-[4-(4-cyanophenyl)phenoxy]ethyl]-1-pyrrolidin-1-iumyl]carbamic acid IUPAC Name: [1-[2-[4-(4-cyanophenyl)phenoxy]ethyl]pyrrolidin-1-ium-1-yl]carbamic acid Traditional Name: [1-[2-[4-(4-cyanophenyl)phenoxy]ethyl]pyrrolidin-1-ium-1-yl]carbamic acid Formula: C20H22N3O3+ MolecularWeight: 352.40698

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](C1)(CCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)NC(=O)O

Isomeric SMILES

C1CC[N+](C1)(CCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)NC(=O)O

InChI

InChI=1S/C20H21N3O3/c21-15-16-3-5-17(6-4-16)18-7-9-19(10-8-18)26-14-13-23(22-20(24)25)11-1-2-12-23/h3-10,22H,1-2,11-14H2/p+1