sodium 3-phenyl-2-[(4-propan-2-ylcyclohexyl)carbonylamino]propanoic acid

Systemtic Name: sodium 3-phenyl-2-[(4-propan-2-ylcyclohexyl)carbonylamino]propanoic acid Openeye Name: sodium 2-[(4-isopropylcyclohexanecarbonyl)amino]-3-phenyl-propanoic acid CAS Name: sodium 2-[[oxo-(4-propan-2-ylcyclohexyl)methyl]amino]-3-phenylpropanoic acid IUPAC Name: sodium 3-phenyl-2-[(4-propan-2-ylcyclohexanecarbonyl)amino]propanoic acid Traditional Name: sodium 2-[(4-isopropylcyclohexanecarbonyl)amino]-3-phenyl-propionic acid Formula: C19H27NNaO3+ MolecularWeight: 340.41235

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CCC(CC1)C(=O)NC(CC2=CC=CC=C2)C(=O)O.[Na+]

Isomeric SMILES

CC(C)C1CCC(CC1)C(=O)NC(CC2=CC=CC=C2)C(=O)O.[Na+]

InChI

InChI=1S/C19H27NO3.Na/c1-13(2)15-8-10-16(11-9-15)18(21)20-17(19(22)23)12-14-6-4-3-5-7-14;/h3-7,13,15-17H,8-12H2,1-2H3,(H,20,21)(H,22,23);/q;+1