8-bromanyl-N-(3,4-dimethylphenyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine

Systemtic Name: 8-bromanyl-N-(3,4-dimethylphenyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Openeye Name: 8-bromo-N-(3,4-dimethylphenyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine CAS Name: 8-bromo-N-(3,4-dimethylphenyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine IUPAC Name: 8-bromo-N-(3,4-dimethylphenyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Traditional Name: (8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-(3,4-dimethylphenyl)amine Formula: C18H20BrNO MolecularWeight: 346.2615

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2CCCOC3=C2C=CC(=C3)Br)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2CCCOC3=C2C=CC(=C3)Br)C

InChI

InChI=1S/C18H20BrNO/c1-12-5-7-15(10-13(12)2)20-17-4-3-9-21-18-11-14(19)6-8-16(17)18/h5-8,10-11,17,20H,3-4,9H2,1-2H3