2-[[2-[(2-azanyl-3-phenyl-propanoyl)-(phenylcarbonyl)amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[2-[(2-azanyl-3-phenyl-propanoyl)-(phenylcarbonyl)amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[[2-[(2-amino-3-phenyl-propanoyl)-benzoyl-amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[2-[(2-amino-1-oxo-3-phenylpropyl)-benzoylamino]-1-oxo-3-phenylpropyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[2-[(2-amino-3-phenylpropanoyl)-benzoylamino]-3-phenylpropanoyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[2-[benzoyl(phenylalanyl)amino]-3-phenyl-propanoyl]amino]-4-methyl-valeric acid Formula: C31H35N3O5 MolecularWeight: 529.6267

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)N(C(=O)C2=CC=CC=C2)C(=O)C(CC3=CC=CC=C3)N

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)N(C(=O)C2=CC=CC=C2)C(=O)C(CC3=CC=CC=C3)N

InChI

InChI=1S/C31H35N3O5/c1-21(2)18-26(31(38)39)33-28(35)27(20-23-14-8-4-9-15-23)34(29(36)24-16-10-5-11-17-24)30(37)25(32)19-22-12-6-3-7-13-22/h3-17,21,25-27H,18-20,32H2,1-2H3,(H,33,35)(H,38,39)