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

Systemtic Name: N,N-dimethyl-4-[6-methyl-8-(2-phenylpropan-2-yl)-2H-1,3-benzoxazin-3-ium-3-yl]aniline Openeye Name: N,N-dimethyl-4-[6-methyl-8-(1-methyl-1-phenyl-ethyl)-2H-1,3-benzoxazin-3-ium-3-yl]aniline CAS Name: N,N-dimethyl-4-[6-methyl-8-(2-phenylpropan-2-yl)-2H-1,3-benzoxazin-3-ium-3-yl]aniline IUPAC Name: N,N-dimethyl-4-[6-methyl-8-(2-phenylpropan-2-yl)-2H-1,3-benzoxazin-3-ium-3-yl]aniline Traditional Name: [4-(8-cumyl-6-methyl-2H-1,3-benzoxazin-3-ium-3-yl)phenyl]-dimethyl-amine Formula: C26H29N2O+ MolecularWeight: 385.52126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C=[N+](CO2)C3=CC=C(C=C3)N(C)C)C(C)(C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C2C(=C1)C=[N+](CO2)C3=CC=C(C=C3)N(C)C)C(C)(C)C4=CC=CC=C4

InChI

InChI=1S/C26H29N2O/c1-19-15-20-17-28(23-13-11-22(12-14-23)27(4)5)18-29-25(20)24(16-19)26(2,3)21-9-7-6-8-10-21/h6-17H,18H2,1-5H3/q+1