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

Systemtic Name: 6-tert-butyl-3-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,3-benzoxazin-3-ium Openeye Name: 6-tert-butyl-3-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,3-benzoxazin-3-ium CAS Name: 6-tert-butyl-3-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,3-benzoxazin-3-ium IUPAC Name: 6-tert-butyl-3-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,3-benzoxazin-3-ium Traditional Name: 6-tert-butyl-3-(4-chlorobenzyl)-3,4-dihydro-2H-1,3-benzoxazin-3-ium Formula: C19H23ClNO+ MolecularWeight: 316.84502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OC[NH+](C2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OC[NH+](C2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H22ClNO/c1-19(2,3)16-6-9-18-15(10-16)12-21(13-22-18)11-14-4-7-17(20)8-5-14/h4-10H,11-13H2,1-3H3/p+1