8-bromanyl-N-[(3-methylphenyl)methyl]-2,3,4,5-tetrahydro-1-benzoxepin-5-amine

Systemtic Name: 8-bromanyl-N-[(3-methylphenyl)methyl]-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Openeye Name: 8-bromo-N-(m-tolylmethyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine CAS Name: 8-bromo-N-[(3-methylphenyl)methyl]-2,3,4,5-tetrahydro-1-benzoxepin-5-amine IUPAC Name: 8-bromo-N-[(3-methylphenyl)methyl]-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Traditional Name: (8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-(3-methylbenzyl)amine Formula: C18H20BrNO MolecularWeight: 346.2615

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC2CCCOC3=C2C=CC(=C3)Br

Isomeric SMILES

CC1=CC(=CC=C1)CNC2CCCOC3=C2C=CC(=C3)Br

InChI

InChI=1S/C18H20BrNO/c1-13-4-2-5-14(10-13)12-20-17-6-3-9-21-18-11-15(19)7-8-16(17)18/h2,4-5,7-8,10-11,17,20H,3,6,9,12H2,1H3