3-methyl-2-[[2-[[3-methyl-2-(propylamino)butanoyl]amino]-3-phenyl-propanoyl]amino]butanoic acid

Systemtic Name: 3-methyl-2-[[2-[[3-methyl-2-(propylamino)butanoyl]amino]-3-phenyl-propanoyl]amino]butanoic acid Openeye Name: 3-methyl-2-[[2-[[3-methyl-2-(propylamino)butanoyl]amino]-3-phenyl-propanoyl]amino]butanoic acid CAS Name: 3-methyl-2-[[2-[[3-methyl-1-oxo-2-(propylamino)butyl]amino]-1-oxo-3-phenylpropyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[[2-[[3-methyl-2-(propylamino)butanoyl]amino]-3-phenylpropanoyl]amino]butanoic acid Traditional Name: 3-methyl-2-[[2-[[3-methyl-2-(propylamino)butanoyl]amino]-3-phenyl-propanoyl]amino]butyric acid Formula: C22H35N3O4 MolecularWeight: 405.531

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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