tert-butyl (2S)-2-[2-[[(2R)-2-azanylpropanoyl]amino]ethanoylamino]-3-phenyl-propanoate

Systemtic Name: tert-butyl (2S)-2-[2-[[(2R)-2-azanylpropanoyl]amino]ethanoylamino]-3-phenyl-propanoate Openeye Name: tert-butyl (2S)-2-[[2-[[(2R)-2-aminopropanoyl]amino]acetyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[2-[[(2R)-2-amino-1-oxopropyl]amino]-1-oxoethyl]amino]-3-phenylpropanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[2-[[(2R)-2-aminopropanoyl]amino]acetyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[2-[[(2R)-2-aminopropanoyl]amino]acetyl]amino]-3-phenyl-propionic acid tert-butyl ester Formula: C18H27N3O4 MolecularWeight: 349.42468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC(=O)NC(CC1=CC=CC=C1)C(=O)OC(C)(C)C)N

Isomeric SMILES

C[C@H](C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)OC(C)(C)C)N

InChI

InChI=1S/C18H27N3O4/c1-12(19)16(23)20-11-15(22)21-14(17(24)25-18(2,3)4)10-13-8-6-5-7-9-13/h5-9,12,14H,10-11,19H2,1-4H3,(H,20,23)(H,21,22)/t12-,14+/m1/s1