(phenylmethyl) (2S)-3-phenyl-2-[(4-propan-2-ylcyclohexyl)carbonylamino]propanoate

Systemtic Name: (phenylmethyl) (2S)-3-phenyl-2-[(4-propan-2-ylcyclohexyl)carbonylamino]propanoate Openeye Name: benzyl (2S)-2-[(4-isopropylcyclohexanecarbonyl)amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[oxo-(4-propan-2-ylcyclohexyl)methyl]amino]-3-phenylpropanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-3-phenyl-2-[(4-propan-2-ylcyclohexanecarbonyl)amino]propanoate Traditional Name: (2S)-2-[(4-isopropylcyclohexanecarbonyl)amino]-3-phenyl-propionic acid benzyl ester Formula: C26H33NO3 MolecularWeight: 407.54512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CCC(CC1)C(=O)NC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)C1CCC(CC1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H33NO3/c1-19(2)22-13-15-23(16-14-22)25(28)27-24(17-20-9-5-3-6-10-20)26(29)30-18-21-11-7-4-8-12-21/h3-12,19,22-24H,13-18H2,1-2H3,(H,27,28)/t22?,23?,24-/m0/s1