[(1R)-3-methyl-1-[[(2S)-2-phenyl-2-(phenylmethoxycarbonylamino)ethanoyl]amino]butyl]azanium

Systemtic Name: [(1R)-3-methyl-1-[[(2S)-2-phenyl-2-(phenylmethoxycarbonylamino)ethanoyl]amino]butyl]azanium Openeye Name: [(1R)-1-[[(2S)-2-(benzyloxycarbonylamino)-2-phenyl-acetyl]amino]-3-methyl-butyl]ammonium CAS Name: [(1R)-3-methyl-1-[[(2S)-1-oxo-2-phenyl-2-(phenylmethoxycarbonylamino)ethyl]amino]butyl]ammonium IUPAC Name: [(1R)-3-methyl-1-[[(2S)-2-phenyl-2-(phenylmethoxycarbonylamino)acetyl]amino]butyl]azanium Traditional Name: [(1R)-1-[[(2S)-2-(benzyloxycarbonylamino)-2-phenyl-acetyl]amino]-3-methyl-butyl]ammonium Formula: C21H28N3O3+ MolecularWeight: 370.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC([NH3+])NC(=O)C(C1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@H]([NH3+])NC(=O)[C@H](C1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H27N3O3/c1-15(2)13-18(22)23-20(25)19(17-11-7-4-8-12-17)24-21(26)27-14-16-9-5-3-6-10-16/h3-12,15,18-19H,13-14,22H2,1-2H3,(H,23,25)(H,24,26)/p+1/t18-,19+/m1/s1