(2S)-2-[[(2R)-2-azanylpropanoyl]-phenylmethoxycarbonyl-amino]-4-methyl-pentanoic acid

Systemtic Name: (2S)-2-[[(2R)-2-azanylpropanoyl]-phenylmethoxycarbonyl-amino]-4-methyl-pentanoic acid Openeye Name: (2S)-2-[[(2R)-2-aminopropanoyl]-benzyloxycarbonyl-amino]-4-methyl-pentanoic acid CAS Name: (2S)-2-[[(2R)-2-amino-1-oxopropyl]-phenylmethoxycarbonylamino]-4-methylpentanoic acid IUPAC Name: (2S)-2-[[(2R)-2-aminopropanoyl]-phenylmethoxycarbonylamino]-4-methylpentanoic acid Traditional Name: (2S)-2-[[(2R)-2-aminopropanoyl]-carbobenzoxy-amino]-4-methyl-valeric acid Formula: C17H24N2O5 MolecularWeight: 336.38286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(C(=O)C(C)N)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

C[C@H](C(=O)N([C@@H](CC(C)C)C(=O)O)C(=O)OCC1=CC=CC=C1)N

InChI

InChI=1S/C17H24N2O5/c1-11(2)9-14(16(21)22)19(15(20)12(3)18)17(23)24-10-13-7-5-4-6-8-13/h4-8,11-12,14H,9-10,18H2,1-3H3,(H,21,22)/t12-,14+/m1/s1