(6R)-6-(3-methylphenyl)-3,4,5,6-tetrahydro-2H-1,5-benzoxazocin-5-ium

Systemtic Name: (6R)-6-(3-methylphenyl)-3,4,5,6-tetrahydro-2H-1,5-benzoxazocin-5-ium Openeye Name: (6R)-6-(m-tolyl)-3,4,5,6-tetrahydro-2H-1,5-benzoxazocin-5-ium CAS Name: (6R)-6-(3-methylphenyl)-3,4,5,6-tetrahydro-2H-1,5-benzoxazocin-5-ium IUPAC Name: (6R)-6-(3-methylphenyl)-3,4,5,6-tetrahydro-2H-1,5-benzoxazocin-5-ium Traditional Name: (6R)-6-(m-tolyl)-3,4,5,6-tetrahydro-2H-1,5-benzoxazocin-5-ium Formula: C17H20NO+ MolecularWeight: 254.3468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2C3=CC=CC=C3OCCC[NH2+]2

Isomeric SMILES

CC1=CC=CC(=C1)[C@@H]2C3=CC=CC=C3OCCC[NH2+]2

InChI

InChI=1S/C17H19NO/c1-13-6-4-7-14(12-13)17-15-8-2-3-9-16(15)19-11-5-10-18-17/h2-4,6-9,12,17-18H,5,10-11H2,1H3/p+1/t17-/m1/s1