3-[[(3S)-1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbamoylamino]propyl-diethyl-azanium

Systemtic Name: 3-[[(3S)-1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbamoylamino]propyl-diethyl-azanium Openeye Name: 3-[[(3S)-1-(3,4-dimethylphenyl)-5-oxo-pyrrolidin-3-yl]carbamoylamino]propyl-diethyl-ammonium CAS Name: 3-[[[[(3S)-1-(3,4-dimethylphenyl)-5-oxo-3-pyrrolidinyl]amino]-oxomethyl]amino]propyl-diethylammonium IUPAC Name: 3-[[(3S)-1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]carbamoylamino]propyl-diethylazanium Traditional Name: 3-[[(3S)-1-(3,4-dimethylphenyl)-5-keto-pyrrolidin-3-yl]carbamoylamino]propyl-diethyl-ammonium Formula: C20H33N4O2+ MolecularWeight: 361.50162

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)NC1CC(=O)N(C1)C2=CC(=C(C=C2)C)C

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)N[C@H]1CC(=O)N(C1)C2=CC(=C(C=C2)C)C

InChI

InChI=1S/C20H32N4O2/c1-5-23(6-2)11-7-10-21-20(26)22-17-13-19(25)24(14-17)18-9-8-15(3)16(4)12-18/h8-9,12,17H,5-7,10-11,13-14H2,1-4H3,(H2,21,22,26)/p+1/t17-/m0/s1