1-[3-methyl-2-[[3-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]pentanoyl]amino]pentanoyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-[3-methyl-2-[[3-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]pentanoyl]amino]pentanoyl]pyrrolidine-2-carboxamide Openeye Name: 1-[3-methyl-2-[[3-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]pentanoyl]amino]pentanoyl]pyrrolidine-2-carboxamide CAS Name: 1-[3-methyl-2-[[3-methyl-1-oxo-2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]pentyl]amino]-1-oxopentyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-[3-methyl-2-[[3-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]pentanoyl]amino]pentanoyl]pyrrolidine-2-carboxamide Traditional Name: 1-[3-methyl-2-[[3-methyl-2-[[(E)-3-phenylacryloyl]amino]pentanoyl]amino]pentanoyl]pyrrolidine-2-carboxamide Formula: C26H38N4O4 MolecularWeight: 470.60432

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(C(C)CC)C(=O)N1CCCC1C(=O)N)NC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CCC(C)C(C(=O)NC(C(C)CC)C(=O)N1CCCC1C(=O)N)NC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C26H38N4O4/c1-5-17(3)22(28-21(31)15-14-19-11-8-7-9-12-19)25(33)29-23(18(4)6-2)26(34)30-16-10-13-20(30)24(27)32/h7-9,11-12,14-15,17-18,20,22-23H,5-6,10,13,16H2,1-4H3,(H2,27,32)(H,28,31)(H,29,33)/b15-14+