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

Systemtic Name: (phenylmethyl) 2-[[2-[(2-acetamido-3-phenylmethoxy-butanoyl)amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoate Openeye Name: benzyl 2-[[2-[(2-acetamido-3-benzyloxy-butanoyl)amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoate CAS Name: 2-[[2-[(2-acetamido-1-oxo-3-phenylmethoxybutyl)amino]-3-methyl-1-oxobutyl]amino]-4-methylpentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[2-[(2-acetamido-3-phenylmethoxybutanoyl)amino]-3-methylbutanoyl]amino]-4-methylpentanoate Traditional Name: 2-[[2-[(2-acetamido-3-benzoxy-butanoyl)amino]-3-methyl-butanoyl]amino]-4-methyl-valeric acid benzyl ester Formula: C31H43N3O6 MolecularWeight: 553.68962

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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)NC(=O)C

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)NC(=O)C

InChI

InChI=1S/C31H43N3O6/c1-20(2)17-26(31(38)40-19-25-15-11-8-12-16-25)33-29(36)27(21(3)4)34-30(37)28(32-23(6)35)22(5)39-18-24-13-9-7-10-14-24/h7-16,20-22,26-28H,17-19H2,1-6H3,(H,32,35)(H,33,36)(H,34,37)