(2S)-4-methyl-2-[[(E)-3-phenylprop-2-enyl]carbamoylamino]pentanoate

Systemtic Name: (2S)-4-methyl-2-[[(E)-3-phenylprop-2-enyl]carbamoylamino]pentanoate Openeye Name: (2S)-2-[[(E)-cinnamyl]carbamoylamino]-4-methyl-pentanoate CAS Name: (2S)-4-methyl-2-[[oxo-[[(E)-3-phenylprop-2-enyl]amino]methyl]amino]pentanoate IUPAC Name: (2S)-4-methyl-2-[[(E)-3-phenylprop-2-enyl]carbamoylamino]pentanoate Traditional Name: (2S)-2-[[(E)-cinnamyl]carbamoylamino]-4-methyl-valerate Formula: C16H21N2O3- MolecularWeight: 289.34954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC(=O)NCC=CC1=CC=CC=C1

Isomeric SMILES

CC(C)C[C@@H](C(=O)[O-])NC(=O)NC/C=C/C1=CC=CC=C1

InChI

InChI=1S/C16H22N2O3/c1-12(2)11-14(15(19)20)18-16(21)17-10-6-9-13-7-4-3-5-8-13/h3-9,12,14H,10-11H2,1-2H3,(H,19,20)(H2,17,18,21)/p-1/b9-6+/t14-/m0/s1