methyl (2S)-2-[[(2S)-2-(cyclohex-2-en-1-ylmethylamino)-3-phenyl-propanoyl]amino]hexanoate

Systemtic Name: methyl (2S)-2-[[(2S)-2-(cyclohex-2-en-1-ylmethylamino)-3-phenyl-propanoyl]amino]hexanoate Openeye Name: methyl (2S)-2-[[(2S)-2-(cyclohex-2-en-1-ylmethylamino)-3-phenyl-propanoyl]amino]hexanoate CAS Name: (2S)-2-[[(2S)-2-(1-cyclohex-2-enylmethylamino)-1-oxo-3-phenylpropyl]amino]hexanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2S)-2-(cyclohex-2-en-1-ylmethylamino)-3-phenylpropanoyl]amino]hexanoate Traditional Name: (2S)-2-[[(2S)-2-(cyclohex-2-en-1-ylmethylamino)-3-phenyl-propanoyl]amino]hexanoic acid methyl ester Formula: C23H34N2O3 MolecularWeight: 386.52766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC)NC(=O)C(CC1=CC=CC=C1)NCC2CCCC=C2

Isomeric SMILES

CCCC[C@@H](C(=O)OC)NC(=O)[C@H](CC1=CC=CC=C1)NCC2CCCC=C2

InChI

InChI=1S/C23H34N2O3/c1-3-4-15-20(23(27)28-2)25-22(26)21(16-18-11-7-5-8-12-18)24-17-19-13-9-6-10-14-19/h5,7-9,11-13,19-21,24H,3-4,6,10,14-17H2,1-2H3,(H,25,26)/t19?,20-,21-/m0/s1