[(2R)-1-oxidanylidene-3-phenyl-1-[4-[(phenylmethyl)carbamoyl]piperazin-1-yl]propan-2-yl]azanium

Systemtic Name: [(2R)-1-oxidanylidene-3-phenyl-1-[4-[(phenylmethyl)carbamoyl]piperazin-1-yl]propan-2-yl]azanium Openeye Name: [(1R)-1-benzyl-2-[4-(benzylcarbamoyl)piperazin-1-yl]-2-oxo-ethyl]ammonium CAS Name: [(2R)-1-oxo-1-[4-[oxo-[(phenylmethyl)amino]methyl]-1-piperazinyl]-3-phenylpropan-2-yl]ammonium IUPAC Name: [(2R)-1-[4-(benzylcarbamoyl)piperazin-1-yl]-1-oxo-3-phenylpropan-2-yl]azanium Traditional Name: [(1R)-1-benzyl-2-[4-(benzylcarbamoyl)piperazino]-2-keto-ethyl]ammonium Formula: C21H27N4O2+ MolecularWeight: 367.46468

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C(CC2=CC=CC=C2)[NH3+])C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)[C@@H](CC2=CC=CC=C2)[NH3+])C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O2/c22-19(15-17-7-3-1-4-8-17)20(26)24-11-13-25(14-12-24)21(27)23-16-18-9-5-2-6-10-18/h1-10,19H,11-16,22H2,(H,23,27)/p+1/t19-/m1/s1