(phenylmethyl) 2-[[2-[(2-azanyl-3-methyl-butanoyl)amino]-3-methyl-butanoyl]amino]-3-methyl-butanoate

Systemtic Name: (phenylmethyl) 2-[[2-[(2-azanyl-3-methyl-butanoyl)amino]-3-methyl-butanoyl]amino]-3-methyl-butanoate Openeye Name: benzyl 2-[[2-[(2-amino-3-methyl-butanoyl)amino]-3-methyl-butanoyl]amino]-3-methyl-butanoate CAS Name: 2-[[2-[(2-amino-3-methyl-1-oxobutyl)amino]-3-methyl-1-oxobutyl]amino]-3-methylbutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[2-[(2-amino-3-methylbutanoyl)amino]-3-methylbutanoyl]amino]-3-methylbutanoate Traditional Name: 2-[[2-[(2-amino-3-methyl-butanoyl)amino]-3-methyl-butanoyl]amino]-3-methyl-butyric acid benzyl ester Formula: C22H35N3O4 MolecularWeight: 405.531

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H35N3O4/c1-13(2)17(23)20(26)24-18(14(3)4)21(27)25-19(15(5)6)22(28)29-12-16-10-8-7-9-11-16/h7-11,13-15,17-19H,12,23H2,1-6H3,(H,24,26)(H,25,27)