(phenylmethyl) 2-[[2-[(2-azanyl-3-phenylmethoxy-butanoyl)amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoate

Systemtic Name: (phenylmethyl) 2-[[2-[(2-azanyl-3-phenylmethoxy-butanoyl)amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoate Openeye Name: benzyl 2-[[2-[(2-amino-3-benzyloxy-butanoyl)amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoate CAS Name: 2-[[2-[(2-amino-1-oxo-3-phenylmethoxybutyl)amino]-3-methyl-1-oxobutyl]amino]-4-methylpentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[2-[(2-amino-3-phenylmethoxybutanoyl)amino]-3-methylbutanoyl]amino]-4-methylpentanoate Traditional Name: 2-[[2-[(2-amino-3-benzoxy-butanoyl)amino]-3-methyl-butanoyl]amino]-4-methyl-valeric acid benzyl ester Formula: C29H41N3O5 MolecularWeight: 511.65294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC1=CC=CC=C1)NC(=O)C(C(C)C)NC(=O)C(C(C)OCC2=CC=CC=C2)N

Isomeric SMILES

CC(C)CC(C(=O)OCC1=CC=CC=C1)NC(=O)C(C(C)C)NC(=O)C(C(C)OCC2=CC=CC=C2)N

InChI

InChI=1S/C29H41N3O5/c1-19(2)16-24(29(35)37-18-23-14-10-7-11-15-23)31-28(34)26(20(3)4)32-27(33)25(30)21(5)36-17-22-12-8-6-9-13-22/h6-15,19-21,24-26H,16-18,30H2,1-5H3,(H,31,34)(H,32,33)