1-[4-methyl-2-[2-[[(E)-3-phenylprop-2-enoyl]amino]ethanoylamino]pentanoyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-[4-methyl-2-[2-[[(E)-3-phenylprop-2-enoyl]amino]ethanoylamino]pentanoyl]pyrrolidine-2-carboxamide Openeye Name: 1-[4-methyl-2-[[2-[[(E)-3-phenylprop-2-enoyl]amino]acetyl]amino]pentanoyl]pyrrolidine-2-carboxamide CAS Name: 1-[4-methyl-1-oxo-2-[[1-oxo-2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]ethyl]amino]pentyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-[4-methyl-2-[[2-[[(E)-3-phenylprop-2-enoyl]amino]acetyl]amino]pentanoyl]pyrrolidine-2-carboxamide Traditional Name: 1-[4-methyl-2-[[2-[[(E)-3-phenylacryloyl]amino]acetyl]amino]pentanoyl]pyrrolidine-2-carboxamide Formula: C22H30N4O4 MolecularWeight: 414.498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N4O4/c1-15(2)13-17(22(30)26-12-6-9-18(26)21(23)29)25-20(28)14-24-19(27)11-10-16-7-4-3-5-8-16/h3-5,7-8,10-11,15,17-18H,6,9,12-14H2,1-2H3,(H2,23,29)(H,24,27)(H,25,28)/b11-10+