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

Systemtic Name: [(2S)-3-phenyl-2-[(4-propan-2-ylcyclohexyl)carbonylamino]propanoyl] (2S)-2-azanyl-3-phenyl-propanoate Openeye Name: [(2S)-2-[(4-isopropylcyclohexanecarbonyl)amino]-3-phenyl-propanoyl] (2S)-2-amino-3-phenyl-propanoate CAS Name: (2S)-2-amino-3-phenylpropanoic acid [(2S)-1-oxo-2-[[oxo-(4-propan-2-ylcyclohexyl)methyl]amino]-3-phenylpropyl] ester IUPAC Name: [(2S)-3-phenyl-2-[(4-propan-2-ylcyclohexanecarbonyl)amino]propanoyl] (2S)-2-amino-3-phenylpropanoate Traditional Name: (2S)-2-amino-3-phenyl-propionic acid [(2S)-2-[(4-isopropylcyclohexanecarbonyl)amino]-3-phenyl-propanoyl] ester Formula: C28H36N2O4 MolecularWeight: 464.59644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CCC(CC1)C(=O)NC(CC2=CC=CC=C2)C(=O)OC(=O)C(CC3=CC=CC=C3)N

Isomeric SMILES

CC(C)C1CCC(CC1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)OC(=O)[C@H](CC3=CC=CC=C3)N

InChI

InChI=1S/C28H36N2O4/c1-19(2)22-13-15-23(16-14-22)26(31)30-25(18-21-11-7-4-8-12-21)28(33)34-27(32)24(29)17-20-9-5-3-6-10-20/h3-12,19,22-25H,13-18,29H2,1-2H3,(H,30,31)/t22?,23?,24-,25-/m0/s1