aminocarbonyl-[2-[(E)-azanyloxymethylideneamino]azepan-1-yl]carbonyl-bis(6-isocyanatohexyl)azanium

Systemtic Name: aminocarbonyl-[2-[(E)-azanyloxymethylideneamino]azepan-1-yl]carbonyl-bis(6-isocyanatohexyl)azanium Openeye Name: [2-[(E)-aminooxymethyleneamino]azepane-1-carbonyl]-carbamoyl-bis(6-isocyanatohexyl)ammonium CAS Name: [[2-[(E)-aminooxymethylideneamino]-1-azepanyl]-oxomethyl]-carbamoyl-bis(6-isocyanatohexyl)ammonium IUPAC Name: [2-[(E)-aminooxymethylideneamino]azepane-1-carbonyl]-carbamoyl-bis(6-isocyanatohexyl)azanium Traditional Name: [2-[(E)-aminooxymethyleneamino]azepane-1-carbonyl]-carbamoyl-bis(6-isocyanatohexyl)ammonium Formula: C23H40N7O5+ MolecularWeight: 494.6076

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(N(CC1)C(=O)[N+](CCCCCCN=C=O)(CCCCCCN=C=O)C(=O)N)N=CON

Isomeric SMILES

C1CCC(N(CC1)C(=O)[N+](CCCCCCN=C=O)(CCCCCCN=C=O)C(=O)N)/N=C/ON

InChI

InChI=1S/C23H39N7O5/c24-22(33)30(16-10-3-1-7-13-26-18-31,17-11-4-2-8-14-27-19-32)23(34)29-15-9-5-6-12-21(29)28-20-35-25/h20-21H,1-17,25H2,(H-,24,33)/p+1/b28-20+