methyl-[2-[[(3S)-5-oxidanylidene-1-phenyl-pyrrolidin-3-yl]carbamoylamino]ethyl]-(phenylmethyl)azanium

Systemtic Name: methyl-[2-[[(3S)-5-oxidanylidene-1-phenyl-pyrrolidin-3-yl]carbamoylamino]ethyl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[2-[[(3S)-5-oxo-1-phenyl-pyrrolidin-3-yl]carbamoylamino]ethyl]ammonium CAS Name: methyl-[2-[[oxo-[[(3S)-5-oxo-1-phenyl-3-pyrrolidinyl]amino]methyl]amino]ethyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[2-[[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]carbamoylamino]ethyl]azanium Traditional Name: benzyl-[2-[[(3S)-5-keto-1-phenyl-pyrrolidin-3-yl]carbamoylamino]ethyl]-methyl-ammonium Formula: C21H27N4O2+ MolecularWeight: 367.46468

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCNC(=O)NC1CC(=O)N(C1)C2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

C[NH+](CCNC(=O)N[C@H]1CC(=O)N(C1)C2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O2/c1-24(15-17-8-4-2-5-9-17)13-12-22-21(27)23-18-14-20(26)25(16-18)19-10-6-3-7-11-19/h2-11,18H,12-16H2,1H3,(H2,22,23,27)/p+1/t18-/m0/s1