N-cyclopropyl-2-[4-[(3R)-1-(2-ethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[(3R)-1-(2-ethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-[(3R)-1-(2-ethoxyphenyl)-5-oxo-pyrrolidine-3-carbonyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[[(3R)-1-(2-ethoxyphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[(3R)-1-(2-ethoxyphenyl)-5-oxopyrrolidine-3-carbonyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-[(3R)-5-keto-1-o-phenetyl-pyrrolidine-3-carbonyl]piperazin-1-ium-1-yl]acetamide Formula: C22H31N4O4+ MolecularWeight: 415.50594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC(CC2=O)C(=O)N3CC[NH+](CC3)CC(=O)NC4CC4

Isomeric SMILES

CCOC1=CC=CC=C1N2C[C@@H](CC2=O)C(=O)N3CC[NH+](CC3)CC(=O)NC4CC4

InChI

InChI=1S/C22H30N4O4/c1-2-30-19-6-4-3-5-18(19)26-14-16(13-21(26)28)22(29)25-11-9-24(10-12-25)15-20(27)23-17-7-8-17/h3-6,16-17H,2,7-15H2,1H3,(H,23,27)/p+1/t16-/m1/s1