2-[2-[[(3R)-1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzimidazol-1-yl]ethyl-diethyl-azanium

Systemtic Name: 2-[2-[[(3R)-1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzimidazol-1-yl]ethyl-diethyl-azanium Openeye Name: 2-[2-[[(3R)-1-(1,3-benzodioxol-5-yl)-5-oxo-pyrrolidine-3-carbonyl]amino]benzimidazol-1-yl]ethyl-diethyl-ammonium CAS Name: 2-[2-[[[(3R)-1-(1,3-benzodioxol-5-yl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]-1-benzimidazolyl]ethyl-diethylammonium IUPAC Name: 2-[2-[[(3R)-1-(1,3-benzodioxol-5-yl)-5-oxopyrrolidine-3-carbonyl]amino]benzimidazol-1-yl]ethyl-diethylazanium Traditional Name: 2-[2-[[(3R)-1-(1,3-benzodioxol-5-yl)-5-keto-pyrrolidine-3-carbonyl]amino]benzimidazol-1-yl]ethyl-diethyl-ammonium Formula: C25H30N5O4+ MolecularWeight: 464.5368

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3CC(=O)N(C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC[NH+](CC)CCN1C2=CC=CC=C2N=C1NC(=O)[C@@H]3CC(=O)N(C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H29N5O4/c1-3-28(4-2)11-12-29-20-8-6-5-7-19(20)26-25(29)27-24(32)17-13-23(31)30(15-17)18-9-10-21-22(14-18)34-16-33-21/h5-10,14,17H,3-4,11-13,15-16H2,1-2H3,(H,26,27,32)/p+1/t17-/m1/s1