1-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]-3-(5-phenyl-1,3-oxazol-2-yl)propan-1-one

Systemtic Name: 1-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]-3-(5-phenyl-1,3-oxazol-2-yl)propan-1-one Openeye Name: 1-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]-3-(5-phenyloxazol-2-yl)propan-1-one CAS Name: 1-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazin-4-iumyl]-3-(5-phenyl-2-oxazolyl)-1-propanone IUPAC Name: 1-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-4-ium-1-yl]-3-(5-phenyl-1,3-oxazol-2-yl)propan-1-one Traditional Name: 1-[4-(2-keto-2-pyrrolidino-ethyl)piperazin-4-ium-1-yl]-3-(5-phenyloxazol-2-yl)propan-1-one Formula: C22H29N4O3+ MolecularWeight: 397.49066

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)C(=O)CCC3=NC=C(O3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)C(=O)CCC3=NC=C(O3)C4=CC=CC=C4

InChI

InChI=1S/C22H28N4O3/c27-21(9-8-20-23-16-19(29-20)18-6-2-1-3-7-18)26-14-12-24(13-15-26)17-22(28)25-10-4-5-11-25/h1-3,6-7,16H,4-5,8-15,17H2/p+1