methyl 4-[3-[3-(heptylamino)-2-methyl-5-oxidanylidene-2H-furan-4-yl]propyl]benzoate

Systemtic Name: methyl 4-[3-[3-(heptylamino)-2-methyl-5-oxidanylidene-2H-furan-4-yl]propyl]benzoate Openeye Name: methyl 4-[3-[3-(heptylamino)-2-methyl-5-oxo-2H-furan-4-yl]propyl]benzoate CAS Name: 4-[3-[3-(heptylamino)-2-methyl-5-oxo-2H-furan-4-yl]propyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-[3-(heptylamino)-2-methyl-5-oxo-2H-furan-4-yl]propyl]benzoate Traditional Name: 4-[3-[3-(heptylamino)-5-keto-2-methyl-2H-furan-4-yl]propyl]benzoic acid methyl ester Formula: C23H33NO4 MolecularWeight: 387.51242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC1=C(C(=O)OC1C)CCCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCCCCCCNC1=C(C(=O)OC1C)CCCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C23H33NO4/c1-4-5-6-7-8-16-24-21-17(2)28-23(26)20(21)11-9-10-18-12-14-19(15-13-18)22(25)27-3/h12-15,17,24H,4-11,16H2,1-3H3