methyl 5-[[4-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-1,4-diazepan-1-yl]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[4-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-1,4-diazepan-1-yl]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[4-[[3-(cyclopentoxy)-4-methoxy-phenyl]methyl]-1,4-diazepan-1-yl]methyl]furan-2-carboxylate CAS Name: 5-[[4-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]methyl]furan-2-carboxylate Traditional Name: 5-[[4-[3-(cyclopentoxy)-4-methoxy-benzyl]-1,4-diazepan-1-yl]methyl]furan-2-carboxylic acid methyl ester Formula: C25H34N2O5 MolecularWeight: 442.54786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCCN(CC2)CC3=CC=C(O3)C(=O)OC)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCCN(CC2)CC3=CC=C(O3)C(=O)OC)OC4CCCC4

InChI

InChI=1S/C25H34N2O5/c1-29-22-10-8-19(16-24(22)31-20-6-3-4-7-20)17-26-12-5-13-27(15-14-26)18-21-9-11-23(32-21)25(28)30-2/h8-11,16,20H,3-7,12-15,17-18H2,1-2H3