ethyl 5-[4-(2-cyanoethanoyl)phenyl]-2-[(4-methylcyclohexyl)carbonyl-propan-2-yl-amino]furan-3-carboxylate

Systemtic Name: ethyl 5-[4-(2-cyanoethanoyl)phenyl]-2-[(4-methylcyclohexyl)carbonyl-propan-2-yl-amino]furan-3-carboxylate Openeye Name: ethyl 5-[4-(2-cyanoacetyl)phenyl]-2-[isopropyl-(4-methylcyclohexanecarbonyl)amino]furan-3-carboxylate CAS Name: 5-[4-(2-cyano-1-oxoethyl)phenyl]-2-[[(4-methylcyclohexyl)-oxomethyl]-propan-2-ylamino]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-(2-cyanoacetyl)phenyl]-2-[(4-methylcyclohexanecarbonyl)-propan-2-ylamino]furan-3-carboxylate Traditional Name: 5-[4-(2-cyanoacetyl)phenyl]-2-[isopropyl-(4-methylcyclohexanecarbonyl)amino]furan-3-carboxylic acid ethyl ester Formula: C27H32N2O5 MolecularWeight: 464.55338

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1)C2=CC=C(C=C2)C(=O)CC#N)N(C(C)C)C(=O)C3CCC(CC3)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1)C2=CC=C(C=C2)C(=O)CC#N)N(C(C)C)C(=O)C3CCC(CC3)C

InChI

InChI=1S/C27H32N2O5/c1-5-33-27(32)22-16-24(20-12-10-19(11-13-20)23(30)14-15-28)34-26(22)29(17(2)3)25(31)21-8-6-18(4)7-9-21/h10-13,16-18,21H,5-9,14H2,1-4H3