4-[6,8-bis(2-phenylpropan-2-yl)-2H-1,3-benzoxazin-3-ium-3-yl]-N,N-dimethyl-aniline

Systemtic Name: 4-[6,8-bis(2-phenylpropan-2-yl)-2H-1,3-benzoxazin-3-ium-3-yl]-N,N-dimethyl-aniline Openeye Name: 4-[6,8-bis(1-methyl-1-phenyl-ethyl)-2H-1,3-benzoxazin-3-ium-3-yl]-N,N-dimethyl-aniline CAS Name: 4-[6,8-bis(2-phenylpropan-2-yl)-2H-1,3-benzoxazin-3-ium-3-yl]-N,N-dimethylaniline IUPAC Name: 4-[6,8-bis(2-phenylpropan-2-yl)-2H-1,3-benzoxazin-3-ium-3-yl]-N,N-dimethylaniline Traditional Name: [4-(6,8-dicumyl-2H-1,3-benzoxazin-3-ium-3-yl)phenyl]-dimethyl-amine Formula: C34H37N2O+ MolecularWeight: 489.67038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=CC(=C3C(=C2)C=[N+](CO3)C4=CC=C(C=C4)N(C)C)C(C)(C)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=CC(=C3C(=C2)C=[N+](CO3)C4=CC=C(C=C4)N(C)C)C(C)(C)C5=CC=CC=C5

InChI

InChI=1S/C34H37N2O/c1-33(2,26-13-9-7-10-14-26)28-21-25-23-36(30-19-17-29(18-20-30)35(5)6)24-37-32(25)31(22-28)34(3,4)27-15-11-8-12-16-27/h7-23H,24H2,1-6H3/q+1