[4-(4-azanylbutyl)-1,4-diazepan-1-yl]-(2,5-dimethylfuran-3-yl)methanone

Systemtic Name: [4-(4-azanylbutyl)-1,4-diazepan-1-yl]-(2,5-dimethylfuran-3-yl)methanone Openeye Name: [4-(4-aminobutyl)-1,4-diazepan-1-yl]-(2,5-dimethyl-3-furyl)methanone CAS Name: [4-(4-aminobutyl)-1,4-diazepan-1-yl]-(2,5-dimethyl-3-furanyl)methanone IUPAC Name: [4-(4-aminobutyl)-1,4-diazepan-1-yl]-(2,5-dimethylfuran-3-yl)methanone Traditional Name: [4-(4-aminobutyl)-1,4-diazepan-1-yl]-(2,5-dimethyl-3-furyl)methanone Formula: C16H27N3O2 MolecularWeight: 293.40448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)N2CCCN(CC2)CCCCN

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)N2CCCN(CC2)CCCCN

InChI

InChI=1S/C16H27N3O2/c1-13-12-15(14(2)21-13)16(20)19-9-5-8-18(10-11-19)7-4-3-6-17/h12H,3-11,17H2,1-2H3