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

Systemtic Name: 3-[[(3S)-1-(4-methoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbamoylamino]propyl-dipropyl-azanium Openeye Name: 3-[[(3S)-1-(4-methoxyphenyl)-5-oxo-pyrrolidin-3-yl]carbamoylamino]propyl-dipropyl-ammonium CAS Name: 3-[[[[(3S)-1-(4-methoxyphenyl)-5-oxo-3-pyrrolidinyl]amino]-oxomethyl]amino]propyl-dipropylammonium IUPAC Name: 3-[[(3S)-1-(4-methoxyphenyl)-5-oxopyrrolidin-3-yl]carbamoylamino]propyl-dipropylazanium Traditional Name: 3-[[(3S)-5-keto-1-(4-methoxyphenyl)pyrrolidin-3-yl]carbamoylamino]propyl-dipropyl-ammonium Formula: C21H35N4O3+ MolecularWeight: 391.5276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H34N4O3/c1-4-12-24(13-5-2)14-6-11-22-21(27)23-17-15-20(26)25(16-17)18-7-9-19(28-3)10-8-18/h7-10,17H,4-6,11-16H2,1-3H3,(H2,22,23,27)/p+1/t17-/m0/s1