ethyl 4-[5-[(2,4,4-trimethylpentan-2-ylamino)methyl]furan-2-yl]benzoate

Systemtic Name: ethyl 4-[5-[(2,4,4-trimethylpentan-2-ylamino)methyl]furan-2-yl]benzoate Openeye Name: ethyl 4-[5-[(1,1,3,3-tetramethylbutylamino)methyl]-2-furyl]benzoate CAS Name: 4-[5-[(2,4,4-trimethylpentan-2-ylamino)methyl]-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-[(2,4,4-trimethylpentan-2-ylamino)methyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(1,1,3,3-tetramethylbutylamino)methyl]-2-furyl]benzoic acid ethyl ester Formula: C22H31NO3 MolecularWeight: 357.48644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)CNC(C)(C)CC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)CNC(C)(C)CC(C)(C)C

InChI

InChI=1S/C22H31NO3/c1-7-25-20(24)17-10-8-16(9-11-17)19-13-12-18(26-19)14-23-22(5,6)15-21(2,3)4/h8-13,23H,7,14-15H2,1-6H3