2-[[(3S)-1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbamoylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(3S)-1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbamoylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[(3S)-1-(3,4-dimethylphenyl)-5-oxo-pyrrolidin-3-yl]carbamoylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[[(3S)-1-(3,4-dimethylphenyl)-5-oxo-3-pyrrolidinyl]amino]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(3S)-1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]carbamoylamino]ethyl-dimethylazanium Traditional Name: 2-[[(3S)-1-(3,4-dimethylphenyl)-5-keto-pyrrolidin-3-yl]carbamoylamino]ethyl-dimethyl-ammonium Formula: C17H27N4O2+ MolecularWeight: 319.42188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)NC(=O)NCC[NH+](C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C[C@H](CC2=O)NC(=O)NCC[NH+](C)C)C

InChI

InChI=1S/C17H26N4O2/c1-12-5-6-15(9-13(12)2)21-11-14(10-16(21)22)19-17(23)18-7-8-20(3)4/h5-6,9,14H,7-8,10-11H2,1-4H3,(H2,18,19,23)/p+1/t14-/m0/s1