(2S)-1-[(2S)-4-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]pentanoyl]-N-prop-2-enyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[(2S)-4-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]pentanoyl]-N-prop-2-enyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-allyl-1-[(2S)-4-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]pentanoyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-[(2S)-4-methyl-1-oxo-2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]pentyl]-N-prop-2-enyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[(2S)-4-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]pentanoyl]-N-prop-2-enylpyrrolidine-2-carboxamide Traditional Name: (2S)-N-allyl-1-[(2S)-4-methyl-2-[[(E)-3-phenylacryloyl]amino]pentanoyl]pyrrolidine-2-carboxamide Formula: C23H31N3O3 MolecularWeight: 397.51054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCCC1C(=O)NCC=C)NC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@@H](C(=O)N1CCC[C@H]1C(=O)NCC=C)NC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C23H31N3O3/c1-4-14-24-22(28)20-11-8-15-26(20)23(29)19(16-17(2)3)25-21(27)13-12-18-9-6-5-7-10-18/h4-7,9-10,12-13,17,19-20H,1,8,11,14-16H2,2-3H3,(H,24,28)(H,25,27)/b13-12+/t19-,20-/m0/s1