3-methyl-6,8-bis(2-phenylpropan-2-yl)-2H-1,3-benzoxazin-3-ium

Systemtic Name: 3-methyl-6,8-bis(2-phenylpropan-2-yl)-2H-1,3-benzoxazin-3-ium Openeye Name: 3-methyl-6,8-bis(1-methyl-1-phenyl-ethyl)-2H-1,3-benzoxazin-3-ium CAS Name: 3-methyl-6,8-bis(2-phenylpropan-2-yl)-2H-1,3-benzoxazin-3-ium IUPAC Name: 3-methyl-6,8-bis(2-phenylpropan-2-yl)-2H-1,3-benzoxazin-3-ium Traditional Name: 6,8-dicumyl-3-methyl-2H-1,3-benzoxazin-3-ium Formula: C27H30NO+ MolecularWeight: 384.5332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H30NO/c1-26(2,21-12-8-6-9-13-21)23-16-20-18-28(5)19-29-25(20)24(17-23)27(3,4)22-14-10-7-11-15-22/h6-18H,19H2,1-5H3/q+1