3,4-dihydro-2H-1,4-benzoxazin-6-ylmethyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3,4-dihydro-2H-1,4-benzoxazin-6-ylmethyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-(3,4-dihydro-2H-1,4-benzoxazin-6-ylmethyl)-methyl-ammonium CAS Name: 3,4-dihydro-2H-1,4-benzoxazin-6-ylmethyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-(3,4-dihydro-2H-1,4-benzoxazin-6-ylmethyl)-methylazanium Traditional Name: benzyl-(3,4-dihydro-2H-1,4-benzoxazin-6-ylmethyl)-methyl-ammonium Formula: C17H21N2O+ MolecularWeight: 269.36144

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC2=CC3=C(C=C2)OCCN3

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC2=CC3=C(C=C2)OCCN3

InChI

InChI=1S/C17H20N2O/c1-19(12-14-5-3-2-4-6-14)13-15-7-8-17-16(11-15)18-9-10-20-17/h2-8,11,18H,9-10,12-13H2,1H3/p+1