[5-[[4-(1-ethanoylpiperidin-4-yl)carbonyl-1,4-diazepan-1-yl]methyl]furan-2-yl]methyl ethanoate

Systemtic Name: [5-[[4-(1-ethanoylpiperidin-4-yl)carbonyl-1,4-diazepan-1-yl]methyl]furan-2-yl]methyl ethanoate Openeye Name: [5-[[4-(1-acetylpiperidine-4-carbonyl)-1,4-diazepan-1-yl]methyl]-2-furyl]methyl acetate CAS Name: acetic acid [5-[[4-[(1-acetyl-4-piperidinyl)-oxomethyl]-1,4-diazepan-1-yl]methyl]-2-furanyl]methyl ester IUPAC Name: [5-[[4-(1-acetylpiperidine-4-carbonyl)-1,4-diazepan-1-yl]methyl]furan-2-yl]methyl acetate Traditional Name: acetic acid [5-[[4-(1-acetylisonipecotoyl)-1,4-diazepan-1-yl]methyl]-2-furyl]methyl ester Formula: C21H31N3O5 MolecularWeight: 405.48794

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)C(=O)N2CCCN(CC2)CC3=CC=C(O3)COC(=O)C

Isomeric SMILES

CC(=O)N1CCC(CC1)C(=O)N2CCCN(CC2)CC3=CC=C(O3)COC(=O)C

InChI

InChI=1S/C21H31N3O5/c1-16(25)23-10-6-18(7-11-23)21(27)24-9-3-8-22(12-13-24)14-19-4-5-20(29-19)15-28-17(2)26/h4-5,18H,3,6-15H2,1-2H3