2-[(3-cyano-4-phenyl-phenyl)methyl-[3-(2-methyl-1,3-dioxolan-2-yl)propanoyl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[(3-cyano-4-phenyl-phenyl)methyl-[3-(2-methyl-1,3-dioxolan-2-yl)propanoyl]amino]-3-methyl-butanoic acid Openeye Name: 2-[(3-cyano-4-phenyl-phenyl)methyl-[3-(2-methyl-1,3-dioxolan-2-yl)propanoyl]amino]-3-methyl-butanoic acid CAS Name: 2-[(3-cyano-4-phenylphenyl)methyl-[3-(2-methyl-1,3-dioxolan-2-yl)-1-oxopropyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[(3-cyano-4-phenylphenyl)methyl-[3-(2-methyl-1,3-dioxolan-2-yl)propanoyl]amino]-3-methylbutanoic acid Traditional Name: 2-[(3-cyano-4-phenyl-benzyl)-[3-(2-methyl-1,3-dioxolan-2-yl)propanoyl]amino]-3-methyl-butyric acid Formula: C26H30N2O5 MolecularWeight: 450.5268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)N(CC1=CC(=C(C=C1)C2=CC=CC=C2)C#N)C(=O)CCC3(OCCO3)C

Isomeric SMILES

CC(C)C(C(=O)O)N(CC1=CC(=C(C=C1)C2=CC=CC=C2)C#N)C(=O)CCC3(OCCO3)C

InChI

InChI=1S/C26H30N2O5/c1-18(2)24(25(30)31)28(23(29)11-12-26(3)32-13-14-33-26)17-19-9-10-22(21(15-19)16-27)20-7-5-4-6-8-20/h4-10,15,18,24H,11-14,17H2,1-3H3,(H,30,31)