3-[[(3S)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbamoylamino]propyl-dipropyl-azanium

Systemtic Name: 3-[[(3S)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbamoylamino]propyl-dipropyl-azanium Openeye Name: 3-[[(3S)-5-oxo-1-(p-tolyl)pyrrolidin-3-yl]carbamoylamino]propyl-dipropyl-ammonium CAS Name: 3-[[[[(3S)-1-(4-methylphenyl)-5-oxo-3-pyrrolidinyl]amino]-oxomethyl]amino]propyl-dipropylammonium IUPAC Name: 3-[[(3S)-1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]carbamoylamino]propyl-dipropylazanium Traditional Name: 3-[[(3S)-5-keto-1-(p-tolyl)pyrrolidin-3-yl]carbamoylamino]propyl-dipropyl-ammonium Formula: C21H35N4O2+ MolecularWeight: 375.5282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H34N4O2/c1-4-12-24(13-5-2)14-6-11-22-21(27)23-18-15-20(26)25(16-18)19-9-7-17(3)8-10-19/h7-10,18H,4-6,11-16H2,1-3H3,(H2,22,23,27)/p+1/t18-/m0/s1