N-(2,6-dimethylphenyl)-2-[4-[(5-ethylfuran-2-yl)methyl]-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-[(5-ethylfuran-2-yl)methyl]-1,4-diazepan-1-yl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-[(5-ethyl-2-furyl)methyl]-1,4-diazepan-1-yl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-[(5-ethyl-2-furanyl)methyl]-1,4-diazepan-1-yl]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-[(5-ethylfuran-2-yl)methyl]-1,4-diazepan-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-[(5-ethyl-2-furyl)methyl]-1,4-diazepan-1-yl]acetamide Formula: C22H31N3O2 MolecularWeight: 369.50044

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(O1)CN2CCCN(CC2)CC(=O)NC3=C(C=CC=C3C)C

Isomeric SMILES

CCC1=CC=C(O1)CN2CCCN(CC2)CC(=O)NC3=C(C=CC=C3C)C

InChI

InChI=1S/C22H31N3O2/c1-4-19-9-10-20(27-19)15-24-11-6-12-25(14-13-24)16-21(26)23-22-17(2)7-5-8-18(22)3/h5,7-10H,4,6,11-16H2,1-3H3,(H,23,26)