(E)-1,4-bis(7-oxidanylideneazepan-2-yl)but-2-ene-1,4-dione

Systemtic Name: (E)-1,4-bis(7-oxidanylideneazepan-2-yl)but-2-ene-1,4-dione Openeye Name: (E)-1,4-bis(7-oxoazepan-2-yl)but-2-ene-1,4-dione CAS Name: (E)-1,4-bis(7-oxo-2-azepanyl)-2-butene-1,4-dione IUPAC Name: (E)-1,4-bis(7-oxoazepan-2-yl)but-2-ene-1,4-dione Traditional Name: (E)-1,4-bis(7-ketoazepan-2-yl)but-2-ene-1,4-dione Formula: C16H22N2O4 MolecularWeight: 306.35688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)NC(C1)C(=O)C=CC(=O)C2CCCCC(=O)N2

Isomeric SMILES

C1CCC(=O)NC(C1)C(=O)/C=C/C(=O)C2CCCCC(=O)N2

InChI

InChI=1S/C16H22N2O4/c19-13(11-5-1-3-7-15(21)17-11)9-10-14(20)12-6-2-4-8-16(22)18-12/h9-12H,1-8H2,(H,17,21)(H,18,22)/b10-9+