methyl 4-[[(5-methylfuran-2-yl)methyl-(oxolan-2-ylmethyl)amino]methyl]benzoate

Systemtic Name: methyl 4-[[(5-methylfuran-2-yl)methyl-(oxolan-2-ylmethyl)amino]methyl]benzoate Openeye Name: methyl 4-[[(5-methyl-2-furyl)methyl-(tetrahydrofuran-2-ylmethyl)amino]methyl]benzoate CAS Name: 4-[[(5-methyl-2-furanyl)methyl-(2-oxolanylmethyl)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(5-methylfuran-2-yl)methyl-(oxolan-2-ylmethyl)amino]methyl]benzoate Traditional Name: 4-[[(5-methyl-2-furyl)methyl-(tetrahydrofurfuryl)amino]methyl]benzoic acid methyl ester Formula: C20H25NO4 MolecularWeight: 343.4168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN(CC2CCCO2)CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(O1)CN(CC2CCCO2)CC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H25NO4/c1-15-5-10-19(25-15)14-21(13-18-4-3-11-24-18)12-16-6-8-17(9-7-16)20(22)23-2/h5-10,18H,3-4,11-14H2,1-2H3