2-[[4-methyl-2-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[4-methyl-2-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-[[2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[4-methyl-2-[[4-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]amino]-1-oxopentyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[4-methyl-2-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-[[2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-phenyl-propionic acid Formula: C29H39N3O6 MolecularWeight: 525.63646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H39N3O6/c1-19(2)15-23(26(33)31-25(28(35)36)17-21-11-7-5-8-12-21)30-27(34)24(16-20(3)4)32-29(37)38-18-22-13-9-6-10-14-22/h5-14,19-20,23-25H,15-18H2,1-4H3,(H,30,34)(H,31,33)(H,32,37)(H,35,36)