methyl (2S)-3-methyl-2-[[(1S)-2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]carbamoylamino]butanoate

Systemtic Name: methyl (2S)-3-methyl-2-[[(1S)-2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]carbamoylamino]butanoate Openeye Name: methyl (2S)-2-[[(1S)-1-(benzyloxycarbonylamino)-2-phenyl-ethyl]carbamoylamino]-3-methyl-butanoate CAS Name: (2S)-3-methyl-2-[[oxo-[[(1S)-2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]amino]methyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2S)-3-methyl-2-[[(1S)-2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]carbamoylamino]butanoate Traditional Name: (2S)-2-[[(1S)-1-(benzyloxycarbonylamino)-2-phenyl-ethyl]carbamoylamino]-3-methyl-butyric acid methyl ester Formula: C23H29N3O5 MolecularWeight: 427.49346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)NC(CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)NC(=O)N[C@H](CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H29N3O5/c1-16(2)20(21(27)30-3)26-22(28)24-19(14-17-10-6-4-7-11-17)25-23(29)31-15-18-12-8-5-9-13-18/h4-13,16,19-20H,14-15H2,1-3H3,(H,25,29)(H2,24,26,28)/t19-,20-/m0/s1