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

Systemtic Name: [5-[[4-(4-cyclohex-2-en-1-yloxyphenyl)carbonyl-1,4-diazepan-1-yl]methyl]furan-2-yl]methyl ethanoate Openeye Name: [5-[[4-(4-cyclohex-2-en-1-yloxybenzoyl)-1,4-diazepan-1-yl]methyl]-2-furyl]methyl acetate CAS Name: acetic acid [5-[[4-[[4-(1-cyclohex-2-enyloxy)phenyl]-oxomethyl]-1,4-diazepan-1-yl]methyl]-2-furanyl]methyl ester IUPAC Name: [5-[[4-(4-cyclohex-2-en-1-yloxybenzoyl)-1,4-diazepan-1-yl]methyl]furan-2-yl]methyl acetate Traditional Name: acetic acid [5-[[4-(4-cyclohex-2-en-1-yloxybenzoyl)-1,4-diazepan-1-yl]methyl]-2-furyl]methyl ester Formula: C26H32N2O5 MolecularWeight: 452.54268

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=CC=C(O1)CN2CCCN(CC2)C(=O)C3=CC=C(C=C3)OC4CCCC=C4

Isomeric SMILES

CC(=O)OCC1=CC=C(O1)CN2CCCN(CC2)C(=O)C3=CC=C(C=C3)OC4CCCC=C4

InChI

InChI=1S/C26H32N2O5/c1-20(29)31-19-25-13-12-24(33-25)18-27-14-5-15-28(17-16-27)26(30)21-8-10-23(11-9-21)32-22-6-3-2-4-7-22/h3,6,8-13,22H,2,4-5,7,14-19H2,1H3