methyl 2-[2-(cyclohexylcarbonylamino)ethanoyloxymethyl]-4-phenyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[2-(cyclohexylcarbonylamino)ethanoyloxymethyl]-4-phenyl-quinoline-3-carboxylate Openeye Name: methyl 2-[[2-(cyclohexanecarbonylamino)acetyl]oxymethyl]-4-phenyl-quinoline-3-carboxylate CAS Name: 2-[[2-[[cyclohexyl(oxo)methyl]amino]-1-oxoethoxy]methyl]-4-phenyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(cyclohexanecarbonylamino)acetyl]oxymethyl]-4-phenylquinoline-3-carboxylate Traditional Name: 2-[[2-(cyclohexanecarbonylamino)acetyl]oxymethyl]-4-phenyl-quinoline-3-carboxylic acid methyl ester Formula: C27H28N2O5 MolecularWeight: 460.52162

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)CNC(=O)C3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)CNC(=O)C3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C27H28N2O5/c1-33-27(32)25-22(17-34-23(30)16-28-26(31)19-12-6-3-7-13-19)29-21-15-9-8-14-20(21)24(25)18-10-4-2-5-11-18/h2,4-5,8-11,14-15,19H,3,6-7,12-13,16-17H2,1H3,(H,28,31)