3-[[(3S)-1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbamoylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(3S)-1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbamoylamino]propyl-dimethyl-azanium Openeye Name: 3-[[(3S)-1-(3-methoxyphenyl)-5-oxo-pyrrolidin-3-yl]carbamoylamino]propyl-dimethyl-ammonium CAS Name: 3-[[[[(3S)-1-(3-methoxyphenyl)-5-oxo-3-pyrrolidinyl]amino]-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(3S)-1-(3-methoxyphenyl)-5-oxopyrrolidin-3-yl]carbamoylamino]propyl-dimethylazanium Traditional Name: 3-[[(3S)-5-keto-1-(3-methoxyphenyl)pyrrolidin-3-yl]carbamoylamino]propyl-dimethyl-ammonium Formula: C17H27N4O3+ MolecularWeight: 335.42128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N4O3/c1-20(2)9-5-8-18-17(23)19-13-10-16(22)21(12-13)14-6-4-7-15(11-14)24-3/h4,6-7,11,13H,5,8-10,12H2,1-3H3,(H2,18,19,23)/p+1/t13-/m0/s1