1-[(3R)-1-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]urea

Systemtic Name: 1-[(3R)-1-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]urea Openeye Name: 1-[(3R)-1-(4-ethoxyphenyl)-5-oxo-pyrrolidin-3-yl]-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]urea CAS Name: 1-[(3R)-1-(4-ethoxyphenyl)-5-oxo-3-pyrrolidinyl]-3-[[(2R)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]urea IUPAC Name: 1-[(3R)-1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]urea Traditional Name: 1-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-[(3R)-5-keto-1-p-phenetyl-pyrrolidin-3-yl]urea Formula: C20H31N4O3+ MolecularWeight: 375.48514

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)NC2CC(=O)N(C2)C3=CC=C(C=C3)OCC

Isomeric SMILES

CC[NH+]1CCC[C@@H]1CNC(=O)N[C@@H]2CC(=O)N(C2)C3=CC=C(C=C3)OCC

InChI

InChI=1S/C20H30N4O3/c1-3-23-11-5-6-17(23)13-21-20(26)22-15-12-19(25)24(14-15)16-7-9-18(10-8-16)27-4-2/h7-10,15,17H,3-6,11-14H2,1-2H3,(H2,21,22,26)/p+1/t15-,17-/m1/s1