cyclooctyl-[2-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: cyclooctyl-[2-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: cyclooctyl-[2-[4-(morpholin-4-ium-4-ylmethyl)anilino]-2-oxo-ethyl]ammonium CAS Name: cyclooctyl-[2-[4-(4-morpholin-4-iumylmethyl)anilino]-2-oxoethyl]ammonium IUPAC Name: cyclooctyl-[2-[4-(morpholin-4-ium-4-ylmethyl)anilino]-2-oxoethyl]azanium Traditional Name: cyclooctyl-[2-keto-2-[4-(morpholin-4-ium-4-ylmethyl)anilino]ethyl]ammonium Formula: C21H35N3O2+2 MolecularWeight: 361.5215

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)[NH2+]CC(=O)NC2=CC=C(C=C2)C[NH+]3CCOCC3

Isomeric SMILES

C1CCCC(CCC1)[NH2+]CC(=O)NC2=CC=C(C=C2)C[NH+]3CCOCC3

InChI

InChI=1S/C21H33N3O2/c25-21(16-22-19-6-4-2-1-3-5-7-19)23-20-10-8-18(9-11-20)17-24-12-14-26-15-13-24/h8-11,19,22H,1-7,12-17H2,(H,23,25)/p+2