7-bromanyl-3-phenethyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine

Systemtic Name: 7-bromanyl-3-phenethyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine Openeye Name: 7-bromo-3-phenethyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine CAS Name: 7-bromo-3-phenethyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine IUPAC Name: 7-bromo-3-phenethyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine Traditional Name: 7-bromo-3-phenethyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine Formula: C17H19BrN2 MolecularWeight: 331.25016

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NCC2=C(N1)C=CC(=C2)Br)CCC3=CC=CC=C3

Isomeric SMILES

C1C(NCC2=C(N1)C=CC(=C2)Br)CCC3=CC=CC=C3

InChI

InChI=1S/C17H19BrN2/c18-15-7-9-17-14(10-15)11-19-16(12-20-17)8-6-13-4-2-1-3-5-13/h1-5,7,9-10,16,19-20H,6,8,11-12H2