methyl 2-cyano-3-(cycloheptylcarbonylamino)-3-(oxan-4-yl)propanoate

Systemtic Name: methyl 2-cyano-3-(cycloheptylcarbonylamino)-3-(oxan-4-yl)propanoate Openeye Name: methyl 2-cyano-3-(cycloheptanecarbonylamino)-3-tetrahydropyran-4-yl-propanoate CAS Name: 2-cyano-3-[[cycloheptyl(oxo)methyl]amino]-3-(4-oxanyl)propanoic acid methyl ester IUPAC Name: methyl 2-cyano-3-(cycloheptanecarbonylamino)-3-(oxan-4-yl)propanoate Traditional Name: 2-cyano-3-(cycloheptanecarbonylamino)-3-tetrahydropyran-4-yl-propionic acid methyl ester Formula: C18H28N2O4 MolecularWeight: 336.42592

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C#N)C(C1CCOCC1)NC(=O)C2CCCCCC2

Isomeric SMILES

COC(=O)C(C#N)C(C1CCOCC1)NC(=O)C2CCCCCC2

InChI

InChI=1S/C18H28N2O4/c1-23-18(22)15(12-19)16(13-8-10-24-11-9-13)20-17(21)14-6-4-2-3-5-7-14/h13-16H,2-11H2,1H3,(H,20,21)