2-[[2-[(2-azanyl-4-methyl-pentanoyl)amino]-4-methyl-pentanoyl]-(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[2-[(2-azanyl-4-methyl-pentanoyl)amino]-4-methyl-pentanoyl]-(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-4-methyl-pentanoic acid Openeye Name: 2-[(2-amino-1-benzyl-2-oxo-ethyl)-[2-[(2-amino-4-methyl-pentanoyl)amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[2-[(2-amino-4-methyl-1-oxopentyl)amino]-4-methyl-1-oxopentyl]-(1-amino-1-oxo-3-phenylpropan-2-yl)amino]-4-methylpentanoic acid IUPAC Name: 2-[[2-[(2-amino-4-methylpentanoyl)amino]-4-methylpentanoyl]-(1-amino-1-oxo-3-phenylpropan-2-yl)amino]-4-methylpentanoic acid Traditional Name: 2-[(2-amino-1-benzyl-2-keto-ethyl)-[2-[(2-amino-4-methyl-pentanoyl)amino]-4-methyl-pentanoyl]amino]-4-methyl-valeric acid Formula: C27H44N4O5 MolecularWeight: 504.66206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC(C)C)C(=O)N(C(CC1=CC=CC=C1)C(=O)N)C(CC(C)C)C(=O)O)N

Isomeric SMILES

CC(C)CC(C(=O)NC(CC(C)C)C(=O)N(C(CC1=CC=CC=C1)C(=O)N)C(CC(C)C)C(=O)O)N

InChI

InChI=1S/C27H44N4O5/c1-16(2)12-20(28)25(33)30-21(13-17(3)4)26(34)31(23(27(35)36)14-18(5)6)22(24(29)32)15-19-10-8-7-9-11-19/h7-11,16-18,20-23H,12-15,28H2,1-6H3,(H2,29,32)(H,30,33)(H,35,36)