6-tert-butyl-3-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,3-benzoxazin-3-ium

Systemtic Name: 6-tert-butyl-3-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,3-benzoxazin-3-ium Openeye Name: 6-tert-butyl-3-(p-tolylmethyl)-3,4-dihydro-2H-1,3-benzoxazin-3-ium CAS Name: 6-tert-butyl-3-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,3-benzoxazin-3-ium IUPAC Name: 6-tert-butyl-3-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,3-benzoxazin-3-ium Traditional Name: 6-tert-butyl-3-(4-methylbenzyl)-3,4-dihydro-2H-1,3-benzoxazin-3-ium Formula: C20H26NO+ MolecularWeight: 296.42654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+]2CC3=C(C=CC(=C3)C(C)(C)C)OC2

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CC3=C(C=CC(=C3)C(C)(C)C)OC2

InChI

InChI=1S/C20H25NO/c1-15-5-7-16(8-6-15)12-21-13-17-11-18(20(2,3)4)9-10-19(17)22-14-21/h5-11H,12-14H2,1-4H3/p+1