methyl 2-[[2-[(2-azanyl-3-phenyl-propanoyl)amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[[2-[(2-azanyl-3-phenyl-propanoyl)amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoate Openeye Name: methyl 2-[[2-[(2-amino-3-phenyl-propanoyl)amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoate CAS Name: 2-[[2-[(2-amino-1-oxo-3-phenylpropyl)amino]-1-oxo-3-phenylpropyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[2-[(2-amino-3-phenylpropanoyl)amino]-3-phenylpropanoyl]amino]-4-methylpentanoate Traditional Name: 4-methyl-2-[[3-phenyl-2-(phenylalanylamino)propanoyl]amino]valeric acid methyl ester Formula: C25H33N3O4 MolecularWeight: 439.54722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC2=CC=CC=C2)N

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC2=CC=CC=C2)N

InChI

InChI=1S/C25H33N3O4/c1-17(2)14-22(25(31)32-3)28-24(30)21(16-19-12-8-5-9-13-19)27-23(29)20(26)15-18-10-6-4-7-11-18/h4-13,17,20-22H,14-16,26H2,1-3H3,(H,27,29)(H,28,30)