2-[[2-dimethylaminoethyl-[(3,5-dimethyl-2-oxidanyl-phenyl)methyl]amino]methyl]-4,6-dimethyl-phenol; oxidanylidenevanadium(2+); propan-2-ol

Systemtic Name: 2-[[2-dimethylaminoethyl-[(3,5-dimethyl-2-oxidanyl-phenyl)methyl]amino]methyl]-4,6-dimethyl-phenol; oxidanylidenevanadium(2+); propan-2-ol Openeye Name: 2-[[2-dimethylaminoethyl-[(2-hydroxy-3,5-dimethyl-phenyl)methyl]amino]methyl]-4,6-dimethyl-phenol; oxovanadium(2+); propan-2-ol CAS Name: 2-[[2-dimethylaminoethyl-[(2-hydroxy-3,5-dimethylphenyl)methyl]amino]methyl]-4,6-dimethylphenol; oxovanadium(2+); 2-propanol IUPAC Name: 2-[[2-dimethylaminoethyl-[(2-hydroxy-3,5-dimethylphenyl)methyl]amino]methyl]-4,6-dimethylphenol; oxovanadium(2+); propan-2-ol Traditional Name: 2-[[2-dimethylaminoethyl-(2-hydroxy-3,5-dimethyl-benzyl)amino]methyl]-4,6-dimethyl-phenol; ketovanadium(2+); propan-2-ol Formula: C25H40N2O4V+2 MolecularWeight: 483.5376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)CN(CCN(C)C)CC2=CC(=CC(=C2O)C)C)O)C.CC(C)O.O=[V+2]

Isomeric SMILES

CC1=CC(=C(C(=C1)CN(CCN(C)C)CC2=CC(=CC(=C2O)C)C)O)C.CC(C)O.O=[V+2]

InChI

InChI=1S/C22H32N2O2.C3H8O.O.V/c1-15-9-17(3)21(25)19(11-15)13-24(8-7-23(5)6)14-20-12-16(2)10-18(4)22(20)26;1-3(2)4;;/h9-12,25-26H,7-8,13-14H2,1-6H3;3-4H,1-2H3;;/q;;;+2