4-(4-cyclohexylphenyl)-2-(furan-2-ylmethylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(4-cyclohexylphenyl)-2-(furan-2-ylmethylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-cyclohexylphenyl)-2-(2-furylmethylamino)-4-oxo-butanoic acid CAS Name: 4-(4-cyclohexylphenyl)-2-(2-furanylmethylamino)-4-oxobutanoic acid IUPAC Name: 4-(4-cyclohexylphenyl)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid Traditional Name: 4-(4-cyclohexylphenyl)-2-(2-furfurylamino)-4-keto-butyric acid Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)C(=O)CC(C(=O)O)NCC3=CC=CO3

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)C(=O)CC(C(=O)O)NCC3=CC=CO3

InChI

InChI=1S/C21H25NO4/c23-20(13-19(21(24)25)22-14-18-7-4-12-26-18)17-10-8-16(9-11-17)15-5-2-1-3-6-15/h4,7-12,15,19,22H,1-3,5-6,13-14H2,(H,24,25)