methyl 4-[[4-[2-dimethylaminoethyl(furan-2-ylcarbonyl)amino]piperidin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[4-[2-dimethylaminoethyl(furan-2-ylcarbonyl)amino]piperidin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[4-[2-dimethylaminoethyl(furan-2-carbonyl)amino]-1-piperidyl]methyl]benzoate CAS Name: 4-[[4-[2-dimethylaminoethyl-[2-furanyl(oxo)methyl]amino]-1-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[2-dimethylaminoethyl(furan-2-carbonyl)amino]piperidin-1-yl]methyl]benzoate Traditional Name: 4-[[4-[2-dimethylaminoethyl(2-furoyl)amino]piperidino]methyl]benzoic acid methyl ester Formula: C23H31N3O4 MolecularWeight: 413.50994

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1CCN(CC1)CC2=CC=C(C=C2)C(=O)OC)C(=O)C3=CC=CO3

Isomeric SMILES

CN(C)CCN(C1CCN(CC1)CC2=CC=C(C=C2)C(=O)OC)C(=O)C3=CC=CO3

InChI

InChI=1S/C23H31N3O4/c1-24(2)14-15-26(22(27)21-5-4-16-30-21)20-10-12-25(13-11-20)17-18-6-8-19(9-7-18)23(28)29-3/h4-9,16,20H,10-15,17H2,1-3H3