4-ethyl-N-[(3S)-1-(4-methoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]piperazin-4-ium-1-carboxamide

Systemtic Name: 4-ethyl-N-[(3S)-1-(4-methoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]piperazin-4-ium-1-carboxamide Openeye Name: 4-ethyl-N-[(3S)-1-(4-methoxyphenyl)-5-oxo-pyrrolidin-3-yl]piperazin-4-ium-1-carboxamide CAS Name: 4-ethyl-N-[(3S)-1-(4-methoxyphenyl)-5-oxo-3-pyrrolidinyl]-1-piperazin-4-iumcarboxamide IUPAC Name: 4-ethyl-N-[(3S)-1-(4-methoxyphenyl)-5-oxopyrrolidin-3-yl]piperazin-4-ium-1-carboxamide Traditional Name: 4-ethyl-N-[(3S)-5-keto-1-(4-methoxyphenyl)pyrrolidin-3-yl]piperazin-4-ium-1-carboxamide Formula: C18H27N4O3+ MolecularWeight: 347.43198

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)NC2CC(=O)N(C2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)N[C@H]2CC(=O)N(C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H26N4O3/c1-3-20-8-10-21(11-9-20)18(24)19-14-12-17(23)22(13-14)15-4-6-16(25-2)7-5-15/h4-7,14H,3,8-13H2,1-2H3,(H,19,24)/p+1/t14-/m0/s1