1-[(5-bromanyl-2-methoxy-phenyl)-(4-methylphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(5-bromanyl-2-methoxy-phenyl)-(4-methylphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(5-bromo-2-methoxy-phenyl)-(p-tolyl)methyl]-1,4-diazepane CAS Name: 1-[(5-bromo-2-methoxyphenyl)-(4-methylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-bromo-2-methoxyphenyl)-(4-methylphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(5-bromo-2-methoxy-phenyl)-(p-tolyl)methyl]-1,4-diazepane Formula: C20H25BrN2O MolecularWeight: 389.3293

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=C(C=CC(=C2)Br)OC)N3CCCNCC3

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=C(C=CC(=C2)Br)OC)N3CCCNCC3

InChI

InChI=1S/C20H25BrN2O/c1-15-4-6-16(7-5-15)20(23-12-3-10-22-11-13-23)18-14-17(21)8-9-19(18)24-2/h4-9,14,20,22H,3,10-13H2,1-2H3